Summary
| Herb Id: TCMCG052 | Herb name: Prunus armeniaca |
| Function: To downbear qi and transform phlegm, relieve cough and calm asthma, moisten intestines and free stool. | Indication: Cough, asthma and fullness due to external contraction cough, intestinal dry and constipation. |
Ingredient
| Ingredient_name: 1-nonene | Alias: NA |
| Ingredient_formula: C9H18 | Ingredient_Smile: CCCCCCCC=C |
| Ingredient_weight: 126.24 g/mol | OB_score: NA |
| PubChem_id: 31285 | EC: - |
| Ingredient_name: 20-Hexadecanoylingenol | Alias: 20-hexadecanoylingenol |
| Ingredient_formula: C36H58O6 | Ingredient_Smile: CCCCCCCCCCCCCCCC(=O)OCC1=CC2C3C(C3(C)C)CC(C4(C2=O)C=C(C(C4(C1O)O)O)C)C |
| Ingredient_weight: 586.94 | OB_score: 28.20395415 |
| PubChem_id: NA | EC: - |
| Ingredient_name: 2,6-decamethylene pyridine | Alias: NA |
| Ingredient_formula: C15H23N | Ingredient_Smile: C1CCCCCC2=CC=CC(=N2)CCCC1 |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: alpha-terpineol | Alias: (S)-alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol; (-)-; (1S)-alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol; 4-(2-Hydroxy-2-propyl)-1-methylcyclohexene; RL00225; MFCD00075926; p-Menth-1-en-8-ol, (S)-(-)-; 10482-56-1; Lily of valley; (R)-2-(4-methylcyclohex-3-enyl)propan-2-ol; CHEMBL447597; UNII-21M14KDA67; 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (theta)-; (+)-alpha-Terpineol, analytical standard; alpha-Terpinol; CAS-10482-56-1; I14-47387; ZINC967595; (R)-alpha-terpineol; (S)-(-)-p-menth-1-en-8-ol; MolPort-003-932-718; AC1Q2JDL; CJ-04634; (+)-p-menth-1-en-8-ol; (+)-?-TERPINEOL; Alpha-terpineol, l; UNII-R53Q4ZWC99 component WUOACPNHFRMFPN-SECBINFHSA-N; EINECS 232-081-5; alpha-Terpineol (mixture of isomers); 21M14KDA67; .alpha.-Terpinol; (-)-alpha-Terpineol; NCGC00357037-01; (R)-2-(4-Methyl-3-cyclohexenyl)isopropanol; WUOACPNHFRMFPN-SECBINFHSA-N; 2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-ol; (4S)-p-menth-1-en-8-ol; HSDB 2683; A-Terpineol; 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, (1S)-; (-)-.alpha.-Terpineol; (+)-; SCHEMBL891812; 2-[(1R)-4-methyl-1-cyclohex-3-enyl]propan-2-ol; FT-0772029; (S)-2-(4-Methyl-3-cyclohexenyl)-2-propanol; AJ-24552; MFCD00171435; 2-(4-methylcyclohex-3-enyl)propan-2-ol (alpha-terpineol); (.+/-.)-.alpha.-Terpineol; SC-47198; DSSTox_CID_31245; .alpha.,.alpha.,4-Trimethyl-3-Cyclohexene-1-methanol; dl-.alpha.-Terpineol; I14-49868; 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, (S)-; AK608361; (+)--Terpineol; CJ-04627; alpha-Terpineol, (+)-; SCHEMBL980991; ZB015495; 3-Cyclohexene-1-methanol, .alpha.,.alpha.4-trimethyl-; alpha-Terpineol, 96% 25g; alpha-Terpineol; EINECS 233-986-8; 2-(4-Methyl-3-cyclohexen-1-yl)-2-propanol #; 2-(4-Methyl-3-cyclohexen-1-yl)-2-propanol; (6R)-p-menth-1-en-8-ol; UNII-R53Q4ZWC99 component WUOACPNHFRMFPN-VIFPVBQESA-N; 8-Hydroxy-p-menth-1-ene; (S)-p-Menth-1-en-8-ol; alpha-terpineol ; FT-0627680; α-terpineol; C11393; alpha- Terpineol; (-)-?-TERPINEOL; AJ-24535; (R)-alpha,alpha,4-Trimethylcyclohex-3-ene-1-methanol; UNII-21334LVV8W component WUOACPNHFRMFPN-VIFPVBQESA-N; UNII-21334LVV8W component WUOACPNHFRMFPN-SECBINFHSA-N; .alpha.-Terpineol, (-)-; 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (1S)-; DTXSID5052672; (L)-alpha-Terpineol; alpha,alpha,4-Trimethyl-(S)-3-Cyclohexene-1-methanol; l-a-Terpineol; L-.alpha.-Terpineol; CHEBI:300; alpha-Terpineol, natural, >=96%, FCC, FG; (S)-alpha-terpineol; FCH4019750; (R)-p-Menth-1-en-8-ol; 1-alpha-terpineol; AC1L9E52; J-500016; (S)-(-)-alpha-terpineol; AKOS030231442; CHEBI:128; C09902; Menth-1-en-8-ol; 2-(4-methylcyclohex-3-enyl)propan-2-ol; 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (1R)-; WUOACPNHFRMFPN-VIFPVBQESA-N; TR-001043; 2-(4-Methyl-3-cyclohexen-1-yl)-2-propanol, (S)-; α- terpineol; (+)-alpha-Terpineol; p-Menth-1-en-8-ol (S)-(-)-; ZINC967799; 7785-53-7; (+)-(4R)-alpha-terpineol; (-)-(4S)-alpha-terpineol; DSSTox_GSID_52672; ZB015467; AT-13574; AKOS015913019; alpha,alpha,4-Trimethyl-(1S)-3-Cyclohexene-1-methanol; alpha-Terpinenol; 2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-ol; MolPort-003-939-209; bmse000667; Tox21_303728; (1R)-alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol; LMPR0102090028; (R)-(+)-alpha-Terpineol; (4R)-p-menth-1-en-8-ol; (S)-(-)-Terpineol; L-alpha-TERPINEOL; 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (S)-; alpha-terpineole; Terpineol, .alpha.; AC1L9CYK |
| Ingredient_formula: C10H18O | Ingredient_Smile: CC1=CCC(CC1)C(C)(C)O |
| Ingredient_weight: 154.25 | OB_score: 34.00869756 |
| PubChem_id: 442501 | EC: 1.1.1.207 [VIEW IN KEGG] 1.1.1.208 [VIEW IN KEGG] 1.3.1.81 [VIEW IN KEGG] 1.14.13.105 [VIEW IN KEGG] 4.2.3.11 [VIEW IN KEGG] 1.1.1.183 [VIEW IN KEGG] 1.1.1.347 [VIEW IN KEGG] 1.14.14.83 [VIEW IN KEGG] 3.1.7.3 [VIEW IN KEGG] 3.1.7.11 [VIEW IN KEGG] 5.4.4.4 [VIEW IN KEGG] 5.4.4.8 [VIEW IN KEGG] 1.1.1.198 [VIEW IN KEGG] 2.3.1.69 [VIEW IN KEGG] 1.1.1.227 [VIEW IN KEGG] 1.1.1.322 [VIEW IN KEGG] 4.2.3.10 [VIEW IN KEGG] 1.14.14.84 [VIEW IN KEGG] 1.14.14.56 [VIEW IN KEGG] 1.14.14.133 [VIEW IN KEGG] 4.2.3.108 [VIEW IN KEGG] 3.1.7.13 [VIEW IN KEGG] 4.2.3.112 [VIEW IN KEGG] 4.2.3.26 [VIEW IN KEGG] 4.2.1.127 [VIEW IN KEGG] 4.2.3.25 [VIEW IN KEGG] 4.2.3.111 [VIEW IN KEGG] 1.1.1.296 [VIEW IN KEGG] 1.1.1.323 [VIEW IN KEGG] |
| Ingredient_name: amygdalin | Alias: (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyacetonitrile; (2R)-2-phenyl-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxymethyl]-2-tetrahydropyranyl]oxy]acetonitrile; (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-acetonitrile; ethane; 2-(hydroxymethyl)-6-[[6-(methoxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]methoxymethyl]oxane-3,4,5-triol; methanenitrile; methylbenzene; molecular hydrogen; (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-ethanenitrile; C08325; CHEBI:17019; (2R)-2-phenyl-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-acetonitrile; 29883-15-6; STOCK1N-52529; (-)-D-mandelonitrile beta-D-gentiobioside; (2R)-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy](phenyl)acetonitrile; A820093; SMP1_000103; Amygdalin; ethane; formonitrile; 2-(hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(methoxymethyl)-2-oxanyl]methoxymethyl]oxane-3,4,5-triol; molecular hydrogen; toluene |
| Ingredient_formula: C20H27NO11 | Ingredient_Smile: C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O |
| Ingredient_weight: 457.43 | OB_score: NA |
| PubChem_id: 134694146 | EC: 3.2.1.21 [VIEW IN KEGG] 3.2.1.117 [VIEW IN KEGG] |
| Ingredient_name: arachidic acid | Alias: n-eicosanoate; eicosanoate; CHEBI:32360; CH3-[CH2]18-COO(-); arachidinate; CH3-[CH2]18-COO(-1); icosanoate; 2lbv; icosanoic acid (n-C20:0); eicosoate; AC1NUU24; arachidicacid |
| Ingredient_formula: C20H40O2 | Ingredient_Smile: CCCCCCCCCCCCCCCCCCCC(=O)O |
| Ingredient_weight: 312.53 | OB_score: NA |
| PubChem_id: 10467 | EC: 6.2.1.24 [VIEW IN KEGG] 3.1.2.2 [VIEW IN KEGG] |
| Ingredient_name: beta-ionone | Alias: (E)-4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-one; (Z)-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one; BB_NC-0321; 4-(2,6,6-Trimethylcyclohex-1-ene-1-yl)-but-3-ene-2-one; NSC 402758; beta-Cyclocitrylideneacetone; SCHEMBL813343; AIDS-032326; AIDS032326; EINECS 238-969-9; 4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-one; .beta.-Cyclocitrylideneacetone; 4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-one; W259500_ALDRICH; 4-(2,6,6-Trimethyl-1-cyclohexen-l-yl)-3-buten-2-one; NSC46137; WLN: L6UTJ A1U1V1 B1 F1 F1; e-4-(2,6,6-trimethyl-cyclohexyl)-but-3-en-2-one; LS-871; EINECS 252-325-4; YJRODKCOICMRBO-BQYQJAHWSA-N; LS-47337; 35031-06-2; ST5306954; trans-.beta.-Ionone; 3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E); IONONE, BETA; EINECS 252-912-5; β- Ionone; 58180_FLUKA; (3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one; 4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one; .beta.-Ionone isomer # 1; C12287; NSC402758; (3E)-4-(2,2,6-TRIMETHYLCYCLOHEXYL)BUT-3-EN-2-ONE; 14901-07-6; 4-(2,6,6-Trimethyl-2(1)-cyclohexen-1-yl)-3-buten-2-one; .beta.-Ionone isomer # 2; SCHEMBL813341; Dihydroionone; ZINC03881456; AC1O5BV0; Ionone, .beta.-; 3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (3E)-; CCRIS 6249; (E)-4-(2,2,6-trimethylcyclohexyl)but-3-en-2-one; 3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)-; I12603_ALDRICH; InChI=1/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7; β-ionone; W259519_ALDRICH; .beta.-Ionone; beta-Ionone; 79-77-6; 3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-; .beta.-Ionene; 4-(2,2,6-Trimethylcyclohexyl)-3-buten-2-one; 36208-32-9 |
| Ingredient_formula: C13H20O | Ingredient_Smile: CC1CCCC(C1C=CC(=O)C)(C)C |
| Ingredient_weight: 192.3 | OB_score: NA |
| PubChem_id: 6431122 | EC: 1.13.11.68 [VIEW IN KEGG] 1.13.11.71 [VIEW IN KEGG] |
| Ingredient_name: cis-9,cis-12-linoleicacid | Alias: cis-9,cis-12-linoleic acid |
| Ingredient_formula: NA | Ingredient_Smile: CCCCCC=CCC=CCCCCCCCC(=O)O |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: citral | Alias: geranialdehyde; Citral, mixture of cis and trans; CITRAL NATURAL; Genanial; Citral (natural); AI3-28519; NCI-C56348; STOCK1N-24160; BRN 1721871; EINECS 226-394-6; Lemsyn GB; NSC 6170; FEMA No. 2303; CHEBI:23316; 2,6-Octadienal, 3,7-dimethyl-, (2E)-; .beta.-Citral; HSDB 993; 27450_FLUKA; LS-201; 3,7-Dimethyl-1,2,6-octadienal; cis/trans-3,7-Dimethyl-2,6-octadienal; CITRAL; Citral alpha; ZINC01529208; Geranaldehyde; (E)-3,7-Dimethyl-2,6-octadienal; Geranial; Citral A; (E)-Neral; (2E)-3,7-dimethylocta-2,6-dienal; NCGC00091550-01; WLN: VH1UY1&3Y1&U1; C83007_ALDRICH; EINECS 205-476-5; citral-b; (E)-Citral; .alpha.-Citral; BRN 1721873; 2,6-Octadienal, 3,7-dimethyl-, (E)-; LMPR01020023; C01499; Geranial and neral mixture; W230308_ALDRICH; 3,7-dimethylocta-2,6-dienal; ST5308094; Lemarome n; 5392-40-5; (E)-3,7-Dimethylocta-2,6-dienal; c1044; 3,7-Dimethyl-trans-2,6-octadienal; W230316_ALDRICH; (E)-Geranial; 4-01-00-03569 (Beilstein Handbook Reference); trans-3,7-Dimethyl-2,6-octadienal; NCGC00091550-02; AI3-01011; EPA Pesticide Chemical Code 040510; AIDS032463; NSC6170; 37350-34-8; FEMA Number 2303; CHEBI:16980; CITRAL SINTETICO; AIDS-032463; beta-Geranial; trans-Citral; geranal; Caswell No. 221B; 3,7-Dimethyl-2,6-octadienal; 2,6-Dimethyloctadien-2,6-al-8; 8022-94-4; 141-27-5; 96680-15-8; CCRIS 1043; 3-01-00-03053 (Beilstein Handbook Reference); 2,6-Octadienal, 3,7-dimethyl-; SCHEMBL3643082; alpha-Citral |
| Ingredient_formula: C10H16O | Ingredient_Smile: CC(=CCCC(=CC=O)C)C |
| Ingredient_weight: 152.23 | OB_score: 22.51593571 |
| PubChem_id: 643779 | EC: 1.1.1.198 [VIEW IN KEGG] 1.14.13.161 [VIEW IN KEGG] 1.14.15.1 [VIEW IN KEGG] 1.3.1.81 [VIEW IN KEGG] 1.14.14.143 [VIEW IN KEGG] 1.14.15.10 [VIEW IN KEGG] 1.1.1.227 [VIEW IN KEGG] 1.1.1.243 [VIEW IN KEGG] 1.14.14.51 [VIEW IN KEGG] 1.1.1.322 [VIEW IN KEGG] 1.1.1.296 [VIEW IN KEGG] 1.3.99.25 [VIEW IN KEGG] 1.14.13.105 [VIEW IN KEGG] 1.1.1.323 [VIEW IN KEGG] 1.1.1.386 [VIEW IN KEGG] 1.14.14.31 [VIEW IN KEGG] 1.17.99.8 [VIEW IN KEGG] 1.1.1.223 [VIEW IN KEGG] 1.14.14.99 [VIEW IN KEGG] 1.1.1.183 [VIEW IN KEGG] 1.1.1.347 [VIEW IN KEGG] 1.2.1.86 [VIEW IN KEGG] 1.1.1.228 [VIEW IN KEGG] 1.14.13.153 [VIEW IN KEGG] 1.1.1.144 [VIEW IN KEGG] 1.14.14.52 [VIEW IN KEGG] 5.5.1.10 [VIEW IN KEGG] 1.14.13.107 [VIEW IN KEGG] 3.3.2.8 [VIEW IN KEGG] 1.1.1.275 [VIEW IN KEGG] 1.14.14.53 [VIEW IN KEGG] 1.3.1.82 [VIEW IN KEGG] |
| Ingredient_name: Citraurin beta | Alias: (3R)-3-Hydroxy-beta-apo-8'-carotenal; 650-69-1; C20894; All-trans-beta-citraurin; Apo-8'-zeaxanthinal; SCHEMBL2958226; (2E,4E,6E,8E,10E,12E,14E,16E)-17-((4R)-4-Hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl)-2,6,11,15-tetramethyl-2,4,6,8,10,12,14,16-heptadecaoctaenal; beta-Citraurin; 3-Hydroxy-beta-apo-8'-carotenal; 3beta-hydroxy-8'-apo-beta-carotenal; beta-Citraurin [MI]; 2,4,6,8,10,12,14,16-Heptadecaoctaenal, 17-((4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl)-2,6,11,15-tetramethyl-, (2E,4E,6E,8E,10E,12E,14E,16E)-; (3R)-3-hydroxy-8'-apo-beta-caroten-8'-al; beta-Citraurin, all-trans-; UNII-GRI2528DO7; CHEBI:53159; 8'-Apozeaxanthinal; citraurin beta; (3R)-3-hydroxy-8'-apo-beta-carotenal; GRI2528DO7 |
| Ingredient_formula: C30H40O2 | Ingredient_Smile: CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=O)C)C |
| Ingredient_weight: 432.64 | OB_score: 20.5343046 |
| PubChem_id: 9845703 | EC: 1.14.99.44 [VIEW IN KEGG] 1.13.11.84 [VIEW IN KEGG] |
| Ingredient_name: Cynanuriculoside A | Alias: cynanuriculoside a |
| Ingredient_formula: NA | Ingredient_Smile: Not Available |
| Ingredient_weight: 1085.43 | OB_score: 14.92278906 |
| PubChem_id: NA | EC: - |
| Ingredient_name: decanoylacetaldehyde | Alias: CHEBI:80815; SCHEMBL1144900; LS-63406; AKOS028110807; C16947; decanoyl acetaldehyde; DTXSID20205050; Dodecanal,3-oxo-; Decanoyl acetaldehyde; 3-Oxododecanal; Houttuynin; CHEMBL443876; Houttuynine; AC1Q6QHJ; CTK1H2308; BRN 1771322; 4-01-00-03730 (Beilstein Handbook Reference); 56505-80-7; AC1L3UZI; Dodecanal, 3-oxo- |
| Ingredient_formula: C14H26O2 | Ingredient_Smile: CCCCCCCCCCCC(=O)CC=O |
| Ingredient_weight: 226.35 g/mol | OB_score: NA |
| PubChem_id: 14443308 | EC: - |
| Ingredient_name: delta-Terpineol | Alias: ZINC5439913; 7299-42-5; EINECS 230-739-6; a,a-Dimethyl-4-methylenecyclohexanemethanol; delta-terpineol; 2-(4-methylenecyclohexyl)propan-2-ol; .delta.-Terpineol; AC1L31XQ; SCHEMBL10779826; 2-(4-methylidenecyclohexyl)propan-2-ol; alpha,alpha-Dimethyl-4-methylenecyclohexanemethanol; D-Terpineol; DTXSID90223266; .alpha.,.alpha.-Dimethyl-4-methylenecyclohexanemethanol; p-Menth-1(7)-en-8-ol; CTK5D7208; SQIFACVGCPWBQZ-UHFFFAOYSA-N; AC1Q76LP; Cyclohexanemethanol, .alpha.,.alpha.-dimethyl-4-methylene- |
| Ingredient_formula: C10H18O | Ingredient_Smile: CC(C)(C1CCC(=C)CC1)O |
| Ingredient_weight: 154.25 | OB_score: 55.10994784 |
| PubChem_id: 81722 | EC: 1.1.1.207 [VIEW IN KEGG] 1.1.1.208 [VIEW IN KEGG] 1.3.1.81 [VIEW IN KEGG] 1.14.13.105 [VIEW IN KEGG] 4.2.3.11 [VIEW IN KEGG] 1.1.1.183 [VIEW IN KEGG] 1.1.1.347 [VIEW IN KEGG] 1.14.14.83 [VIEW IN KEGG] 3.1.7.3 [VIEW IN KEGG] 3.1.7.11 [VIEW IN KEGG] 5.4.4.4 [VIEW IN KEGG] 5.4.4.8 [VIEW IN KEGG] 1.1.1.198 [VIEW IN KEGG] 2.3.1.69 [VIEW IN KEGG] 1.1.1.227 [VIEW IN KEGG] 1.1.1.322 [VIEW IN KEGG] 4.2.3.10 [VIEW IN KEGG] 1.14.14.84 [VIEW IN KEGG] 1.14.14.56 [VIEW IN KEGG] 1.14.14.133 [VIEW IN KEGG] 4.2.3.108 [VIEW IN KEGG] 3.1.7.13 [VIEW IN KEGG] 4.2.3.112 [VIEW IN KEGG] 4.2.3.26 [VIEW IN KEGG] 4.2.1.127 [VIEW IN KEGG] 4.2.3.25 [VIEW IN KEGG] 4.2.3.111 [VIEW IN KEGG] 1.1.1.296 [VIEW IN KEGG] 1.1.1.323 [VIEW IN KEGG] |
| Ingredient_name: dodecane | Alias: AC1NSE4A; 34977-49-6; Dodecyl radical; n-dodecyl radical |
| Ingredient_formula: C12H26 | Ingredient_Smile: CCCCCCCCCCCC |
| Ingredient_weight: 170.33 g/mol | OB_score: NA |
| PubChem_id: 8182 | EC: - |
| Ingredient_name: (e)-2-nonenal | Alias: 2-Nonenal, (2Z)-; 60784-31-8; 3-Z-Nonenal; t-2-nonenal; UNII-93C6BZW2TV component BSAIUMLZVGUGKX-FPLPWBNLSA-N; NSC20746; 3-Hexyl-2-propenal; (E)-2-nonenal; 2-Nonenal (ACD/Name 4.0); trans-2-nonealdehyde; (Z)-2-nonenal; ZINC70450810; (2Z)-2-Nonenal; A817412; 2-Nonen-1-al; (2Z)-NON-2-ENAL; 2-Nonenal, (Z)-; (Z)-Non-2-enal; AC1NS6CJ; Non-2-enal; (E)-2-nonen-1-al; NSC-20746; heptylidene acetaldehyde; (E)-2- nonenal; DTXSID3052274; cis-2-Nonenal; UNII-ARM1W3309Z; EINECS 262-428-6; 3-hexyl-acrolein; ARM1W3309Z; 2-(Z)-Nonenal; SCHEMBL891583; BSAIUMLZVGUGKX-FPLPWBNLSA-N; 2463-53-8 |
| Ingredient_formula: C9H16O | Ingredient_Smile: CCCCCCC=CC=O |
| Ingredient_weight: 140.22 g/mol | OB_score: NA |
| PubChem_id: 5354833 | EC: - |
| Ingredient_name: (E ,E )-2,4-decadienal | Alias: (E,E)-2,4-decadienal; (e, e)-2,4-decadienal; (e,e)-2,4-decadienal |
| Ingredient_formula: C10H16O | Ingredient_Smile: CCCCCC=CC=CC=O |
| Ingredient_weight: 152.23 g/mol | OB_score: NA |
| PubChem_id: 5283349 | EC: 1.1.1.198 [VIEW IN KEGG] 1.14.13.161 [VIEW IN KEGG] 1.14.15.1 [VIEW IN KEGG] 1.3.1.81 [VIEW IN KEGG] 1.14.14.143 [VIEW IN KEGG] 1.14.15.10 [VIEW IN KEGG] 1.1.1.227 [VIEW IN KEGG] 1.1.1.243 [VIEW IN KEGG] 1.14.14.51 [VIEW IN KEGG] 1.1.1.322 [VIEW IN KEGG] 1.1.1.296 [VIEW IN KEGG] 1.3.99.25 [VIEW IN KEGG] 1.14.13.105 [VIEW IN KEGG] 1.1.1.323 [VIEW IN KEGG] 1.1.1.386 [VIEW IN KEGG] 1.14.14.31 [VIEW IN KEGG] 1.17.99.8 [VIEW IN KEGG] 1.1.1.223 [VIEW IN KEGG] 1.14.14.99 [VIEW IN KEGG] 1.1.1.183 [VIEW IN KEGG] 1.1.1.347 [VIEW IN KEGG] 1.2.1.86 [VIEW IN KEGG] 1.1.1.228 [VIEW IN KEGG] 1.14.13.153 [VIEW IN KEGG] 1.1.1.144 [VIEW IN KEGG] 1.14.14.52 [VIEW IN KEGG] 5.5.1.10 [VIEW IN KEGG] 1.14.13.107 [VIEW IN KEGG] 3.3.2.8 [VIEW IN KEGG] 1.1.1.275 [VIEW IN KEGG] 1.14.14.53 [VIEW IN KEGG] 1.3.1.82 [VIEW IN KEGG] |
| Ingredient_name: ent-epiafzelechin-(2α鈫抩鈫?,4α鈫?)-(?)-afze-lechin | Alias: NA |
| Ingredient_formula: C30H24O10 | Ingredient_Smile: C1C(C(OC2=C3C4C(C(OC5=CC(=CC(=C45)O)O)(OC3=CC(=C21)O)C6=CC=C(C=C6)O)O)C7=CC=C(C=C7)O)O |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: ent-epiafzelechin-(2α鈫抩鈫?, 4α鈫?)-(+)-afze-lechin | Alias: NA |
| Ingredient_formula: C30H24O10 | Ingredient_Smile: C1C(C(OC2=C3C4C(C(OC5=CC(=CC(=C45)O)O)(OC3=CC(=C21)O)C6=CC=C(C=C6)O)O)C7=CC=C(C=C7)O)O |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: ent-epiafzelechin-(2α鈫抩鈫?,4α鈫?)-epi-afze-lechin | Alias: NA |
| Ingredient_formula: C30H24O10 | Ingredient_Smile: C1C(C(OC2=C3C4C(C(OC5=CC(=CC(=C45)O)O)(OC3=CC(=C21)O)C6=CC=C(C=C6)O)O)C7=CC=C(C=C7)O)O |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: Flavoxanthin | Alias: flavoxanthin; (2R,6S,7aR)-2-[(1E,3E,5E,7E,9E,11E,13E,15E)-16-[(1R,4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohex-2-enyl]-1,5,10,14-tetramethylhexadeca-1,3,5,7,9,11,13,15-octaenyl]-4,4,7a-trimethyl-2,5,6,7-tetrahydrobenzofuran-6-ol; C08594; (2R,6S,7aR)-2-[(2E,4E,6E,8E,10E,12E,14E,16E)-17-[(1R,4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohex-2-enyl]-6,11,15-trimethylheptadeca-2,4,6,8,10,12,14,16-octaen-2-yl]-4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzofuran-6-ol; 512-29-8; LMPR01070271; (2R,6S,7aR)-2-[(2E,4E,6E,8E,10E,12E,14E,16E)-17-[(1R,4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohex-2-enyl]-6,11,15-trimethyl-heptadeca-2,4,6,8,10,12,14,16-octaen-2-yl]-4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzofuran-6-ol; (2R,6S,7aR)-2-[(1E,3E,5E,7E,9E,11E,13E,15E)-16-[(1R,4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohex-2-enyl]-1,5,10,14-tetramethyl-hexadeca-1,3,5,7,9,11,13,15-octaenyl]-4,4,7a-trimethyl-2,5,6,7-tetrahydrobenzofuran-6-ol |
| Ingredient_formula: C40H56O3 | Ingredient_Smile: CC1=CC(CC(C1C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C2C=C3C(CC(CC3(O2)C)O)(C)C)C)C)(C)C)O |
| Ingredient_weight: 584.87 | OB_score: 60.412944 |
| PubChem_id: 5281238 | EC: 1.14.15.21 [VIEW IN KEGG] 1.23.5.1 [VIEW IN KEGG] 5.3.99.8 [VIEW IN KEGG] |
| Ingredient_name: flemiphilippinin C | Alias: flemiphilippinin c |
| Ingredient_formula: C26H26O6 | Ingredient_Smile: CC(=CCC1=C2C(=C(C3=C1OC=C(C3=O)C4=CC(=C(C=C4)O)OC)O)C=CC(O2)(C)C)C |
| Ingredient_weight: 434.48 | OB_score: 47.66175172 |
| PubChem_id: 5317360 | EC: - |
| Ingredient_name: hexadecanoic acid | Alias: hexadecanoicacid; AC1NS0IJ |
| Ingredient_formula: C16H32O2 | Ingredient_Smile: CCCCCCCCCCCCCCCC(=O)O |
| Ingredient_weight: 256.42 g/mol | OB_score: NA |
| PubChem_id: 985 | EC: 1.2.1.48 [VIEW IN KEGG] 1.11.1.3 [VIEW IN KEGG] 1.14.14.80 [VIEW IN KEGG] 2.3.1.85 [VIEW IN KEGG] 3.1.1.63 [VIEW IN KEGG] 3.1.2.2 [VIEW IN KEGG] 3.1.2.14 [VIEW IN KEGG] 3.1.2.22 [VIEW IN KEGG] 6.2.1.3 [VIEW IN KEGG] 6.2.1.57 [VIEW IN KEGG] |
| Ingredient_name: i-linalool | Alias: NA |
| Ingredient_formula: NA | Ingredient_Smile: CC(=CCCC(C)(C=C)O)C |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: ipolamiide | Alias: NSC729640; NCGC00180239-01; NSC-729640; BRD-A14663384-001-01-0; ACon1_001692 |
| Ingredient_formula: C17H26O11 | Ingredient_Smile: CC1(CCC2(C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O)O |
| Ingredient_weight: 406.4 g/mol | OB_score: NA |
| PubChem_id: 442425 | EC: - |
| Ingredient_name: linalool | Alias: CJ-23937; Spectrum5_000393; LMPR0102010013; AKOS028109218; linalool ; Linalool; 1,6-Octadien-3-ol,3,7-dimethyl-, (3R)-; (R)-3,7-Dimethyl-1,6-octadien-3-ol; AC1L9E4Q; KBioGR_002294; (R)-3,7-dimethylocta-1,6-dien-3-ol; KBio2_003260; Epoxydihydrolinalool; KBio2_000692; (3R)-3,7-dimethylocta-1,6-dien-3-ol; ZINC1529820; Spectrum4_001777; C11388; linalool oxide; 126-91-0; 3U21E3V8I2; KBio3_002285; CCG-38497; CTK8F1408; KBio2_005828; KBioSS_000692; (-)-Linalool; EINECS 204-811-2; (-)-3,7-dimethyl-1,6-octadien-3-ol; LINALOOL (+); (3R)-Linalool; L-LINALOOL, REF. IND.-14<F128><144><F255>; CHEMBL235672; CHEBI:28; SpecPlus_000909; SCHEMBL891312; (-)-Linalool, analytical standard; UNII-3U21E3V8I2; KBio1_001949; J-005448; MolPort-003-666-060; NCGC00095658-01; FT-0772303; BSPBio_002785; SDCCGMLS-0066889.P001; UNII-D81QY6I88E component CDOSHBSSFJOMGT-JTQLQIEISA-N; L-Linalool; 1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, (-)-; L-Linalool, natural, >=95%, FG; SPBio_002007; Spectrum3_001173; 1,6-Octadien-3-ol, 3,7-dimethyl-, (3R)-; NCGC00095658-02; SPECTRUM1501212; SMP2_000331; (-)-Linalool, >=95.0% (sum of enantiomers, GC); Linalool, (-)-; 3R,7-dimethylocta-1,6-dien-3-ol; DivK1c_007005; (R)-linalool; (R)-(-)-3,7-Dimethyl-1,6-octadien-3-ol; DTXSID40872607; laevo-linalool; MFCD00135469; Spectrum2_001944; I14-45868; (3R)-3,7-dimethyl-1,6-octadien-3-ol; Spectrum_000212; (R)-(-)-Linalool |
| Ingredient_formula: C10H18O | Ingredient_Smile: CC(=CCCC(C)(C=C)O)C |
| Ingredient_weight: 154.25 | OB_score: NA |
| PubChem_id: 6549 | EC: 1.1.1.207 [VIEW IN KEGG] 1.1.1.208 [VIEW IN KEGG] 1.3.1.81 [VIEW IN KEGG] 1.14.13.105 [VIEW IN KEGG] 4.2.3.11 [VIEW IN KEGG] 1.1.1.183 [VIEW IN KEGG] 1.1.1.347 [VIEW IN KEGG] 1.14.14.83 [VIEW IN KEGG] 3.1.7.3 [VIEW IN KEGG] 3.1.7.11 [VIEW IN KEGG] 5.4.4.4 [VIEW IN KEGG] 5.4.4.8 [VIEW IN KEGG] 1.1.1.198 [VIEW IN KEGG] 2.3.1.69 [VIEW IN KEGG] 1.1.1.227 [VIEW IN KEGG] 1.1.1.322 [VIEW IN KEGG] 4.2.3.10 [VIEW IN KEGG] 1.14.14.84 [VIEW IN KEGG] 1.14.14.56 [VIEW IN KEGG] 1.14.14.133 [VIEW IN KEGG] 4.2.3.108 [VIEW IN KEGG] 3.1.7.13 [VIEW IN KEGG] 4.2.3.112 [VIEW IN KEGG] 4.2.3.26 [VIEW IN KEGG] 4.2.1.127 [VIEW IN KEGG] 4.2.3.25 [VIEW IN KEGG] 4.2.3.111 [VIEW IN KEGG] 1.1.1.296 [VIEW IN KEGG] 1.1.1.323 [VIEW IN KEGG] |
| Ingredient_name: linolenic acid | Alias: NSC 2042; NCGC00091058-06; sodium (9E,12E)-octadeca-9,12-dienoate; BG00620376; NCGC00091058-05; EINECS 207-334-8; (9E,12E,15E)-9,12,15-Octadecatrienoic acid; STK801963; PO45E3L8YU; (9E,12E)-octadeca-9,12-dienoate; alpha-Lnn; 4CH-024330; ST072192; CHEBI:92583; LS-102392; CMC_7371; 21661-12-1; 9,12,15-all-cis-Octadecatrienoic acid; (9E,12E,15E)-octadeca-9,12,15-trienoic acid; PREVENTION 1 (LINOLENIC ACID)(PREVENTION 1); LS-1275; cis-9, cis-12, cis-15-octadecatrienoic acid; Shiso oil; DTXSID7075058; 9,12,15-Octadecatrienoic acid, (9Z,12Z,15Z)- (9CI); cis-Delta(9,12,15)-octadecatrienoic acid; 9,12,15-Octadecatrienoic acid, (E,E,E)-; AKOS015955691; PERILLA SEED OIL; 62160_FLUKA; ACM1955335; (9Z,12Z,15Z)-9,12,15-Octadecatrienoic acid; 9E,12E,15E-octadecatrienoic acid; Perilla oil [Oil, misc.]; Oils, perilla; C18:3n-3,6,9; CCRIS 7126; Perilla oil; NCGC00091058-04; trans-9, trans-12, trans-15-octadecatrienoic acid; C06427; 28290-79-1; MolPort-001-780-231; DTOSIQBPPRVQHS-IUQGRGSQSA-N; CHEBI:27432; ZINC3870057; EINECS 217-792-0; IDI1_033846; linolenelaidic acid; LMFA01030153; 1955-33-5; delta9,12,15-Octadecatrienoic acid; linolensaure; 62170_FLUKA; (9,12,15)-linolenic acid; NCGC00091058-01; (9E,12E,15E)-9,12,15-Octadecatrienoate; SCHEMBL46586; AC1NYW3V; AC1Q5W6U; linolenicacid; L2376_SIGMA; Perilla frutescens oil; (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid; alpha-Linolenic acid; S14-1210; linolenic acid ; UNII-PO45E3L8YU; 9,12,15-Octadecatrienoic acid; Elaidolinolenic acid; (E,E,E)-9,12,15-Octadecatrienoic acid; BDBM22336; 9,12,15-Octadecatrienoic acid, (9Z,12Z,15Z)-; cis-9,cis-12,cis-15-Octadecatrienoic acid; Elaidolinoleic acid; BSPBio_001376; (all-Z)-9,12,15-Octadecatrienoic acid; Linolenic acid, crude; (9E,12Z,15E)-9,12,15-Octadecatrienoic acid; LMFA01030152; AC1NR0VW; BB_NC-0378; 9Z,12Z,15Z-octadecatrienoic acid; BBL027460; 9,12-octadecadienoate; (9Z,12Z,15Z)-Octadecatrienoic acid |
| Ingredient_formula: C18H30O2 | Ingredient_Smile: CCC=CCC=CCC=CCCCCCCCC(=O)O |
| Ingredient_weight: 278.43 | OB_score: 45.00906591 |
| PubChem_id: 5282822 | EC: 1.14.19.3 [VIEW IN KEGG] 3.1.2.2 [VIEW IN KEGG] 1.13.11.12 [VIEW IN KEGG] 1.13.11.61 [VIEW IN KEGG] 1.13.11.77 [VIEW IN KEGG] 1.13.11.92 [VIEW IN KEGG] 3.1.1.4 [VIEW IN KEGG] 3.1.1.32 [VIEW IN KEGG] 1.14.19.39 [VIEW IN KEGG] |
| Ingredient_name: Linoleyl acetate | Alias: octadeca-9,12-dien-1-yl acetate; acetic acid [(9E,12E)-octadeca-9,12-dienyl] ester; [(9E,12E)-octadeca-9,12-dienyl] ethanoate; 5999-95-1; FT-0635935; linoleyl acetate; [(9E,12E)-octadeca-9,12-dienyl] acetate |
| Ingredient_formula: C20H36O2 | Ingredient_Smile: CCCCCC=CCC=CCCCCCCCCOC(=O)C |
| Ingredient_weight: 308.5 | OB_score: 42.10076623 |
| PubChem_id: 44134803 | EC: 4.2.3.141 [VIEW IN KEGG] |
| Ingredient_name: mandelonitrile | Alias: NA |
| Ingredient_formula: C8H7NO | Ingredient_Smile: C1=CC=C(C=C1)C(C#N)O |
| Ingredient_weight: 133.15 g/mol | OB_score: NA |
| PubChem_id: 10758 | EC: 1.1.3.49 [VIEW IN KEGG] 1.14.14.44 [VIEW IN KEGG] 1.14.14.77 [VIEW IN KEGG] 2.4.1.354 [VIEW IN KEGG] 3.2.1.21 [VIEW IN KEGG] 3.2.1.118 [VIEW IN KEGG] 3.2.1.119 [VIEW IN KEGG] 4.1.2.10 [VIEW IN KEGG] 1.14.14.37 [VIEW IN KEGG] 2.4.1.220 [VIEW IN KEGG] |
| Ingredient_name: mangicrocin | Alias: NA |
| Ingredient_formula: C45H50O19 | Ingredient_Smile: CC(=CC=CC=C(C)C=CC=C(C)OC(=O)CC1C(C(C(C(O1)C2=C(C3=C(C=C2O)OC4=CC(=C(C=C4C3=O)O)O)O)O)O)O)C=CC=C(C)C(=O)OC5C(C(C(C(O5)CO)O)O)O |
| Ingredient_weight: 894.9 g/mol | OB_score: NA |
| PubChem_id: 131751516 | EC: - |
| Ingredient_name: myristic acid | Alias: 1-Tridecanecarboxylic acid; Myristinsaeure; CH3-[CH2]12-COOH; 70079_FLUKA; AI3-15381; LMFA01010014; CH3-[CH2]12-COO(-); NCGC00091068-02; Myristic acid-[9,10-3H]; C06424; Emery 655; myristic acid ; NSC 5028; 70082_FLUKA; C14 fatty acid; ST023797; W276405_ALDRICH; CCRIS 4724; Kortacid 1499; 3uev; TUNFSRHWOTWDNC-UHFFFAOYSA-M; Tetradecanoic acid; EINECS 250-924-5; n-Tetradecoic acid; 4-02-00-01126 (Beilstein Handbook Reference); Hydrofol acid 1495; MYR; BRN 0508624; Myristate; Myristic acid (natural); Tetradecanoate; LS-190125; Crodacid; Myristic acid (8CI); EINECS 208-875-2; Prifac 2942; Myristic acid; AIDS002505; tetradecoate; W276413_ALDRICH; FEMA No. 2764; HSDB 5686; Philacid 1400; CHEBI:28875; Edenor C 14; n-tetradecoate; 45184-05-2; myristicacid; tetradecoic acid; n-Tetradecanoic acid; M3128_SIGMA; AIDS-002505; Univol U 316S; Lead dimyristate; AC1N2PSK; NCGC00091068-01; neo-Fat 14; NSC5028; Tetradecanoic acid (9CI); Hystrene 9014; Myristic acid, pure; M4792_SIGMA; CHEBI:30807; n-Tetradecan-1-oic acid; WLN: QV13; 1-tetradecanecarboxylate; 32112-52-0; n-tetradecan-1-oate; 544-63-8 |
| Ingredient_formula: C14H28O2 | Ingredient_Smile: CCCCCCCCCCCCCC(=O)O |
| Ingredient_weight: 228.37 | OB_score: 21.18117264 |
| PubChem_id: 11005 | EC: 3.1.2.14 [VIEW IN KEGG] |
| Ingredient_name: myristicin | Alias: 4-Methoxy-6-(2-propenyl)-1,3-benzodioxole; 04PD6CT78W; BNWJOHGLIBDBOB-UHFFFAOYSA-N; 4-methoxy-6-prop-2-enyl-1,3-benzodioxole; 1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)-; V0156; STK693140; Myristicin, analytical standard; ZB013050; Myristicin from parsley leaf oil, >=85% (HPLC), oil; UNII-04PD6CT78W; CCG-208543; NCGC00257726-01; Myristicin; 4-Methoxy-6-[2-propenyl]-1,3-benzodioxole; C10480; FCH920323; 6-Allyl-4-methoxy-1,3-benzodioxole; Myristicine; Benzene, 5-allyl-1-methoxy-2,3-(methylenedioxy)-; HMS2270K14; SCHEMBL68041; BRN 0166218; NCGC00091427-03!4-methoxy-6-prop-2-enyl-1,3-benzodioxole; DSSTox_RID_77884; 1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)- (9CI); SBB014760; CAS-607-91-0; 607M910; SR-01000838340-3; 1-Allyl-3-methoxy-4,5-methylenedioxybenzene; M9411_SIGMA; 6-allyl-4-methoxy-1,3-benzodioxol; 1-Methoxy-2,3-methylenedioxy-5-(2-propenyl)benzene; ZERO/009047; AKOS005604763; Myristicin (6CI); MFCD00133549; Myristicin from parsley leaf oil; LS-2163; DSSTox_CID_5693; MLS001065535; MCULE-6209105333; 607-91-0; 4-methoxy-6-(prop-2-en-1-yl)-1,3-benzodioxole; CHEBI:68234; DSSTox_GSID_25693; CCRIS 6782; Tox21_200172; 5-Allyl-2,3-(methylendioxy)anisole; 4-methoxy-6-prop-2-enyl-2H-benzo[d]1,3-dioxolene; 4-Methoxy-6-(2-propenyl)-1,3-benzodioxole, 9CI; ST097616; 3-methoxy,4,5-methylenedioxy-allylbenzene; EINECS 210-146-9; 5-Allyl-1-methoxy-2,3-(methylenedioxy)-Benzene; NCGC00091427-02; MolPort-003-925-569; 4-methoxy-6-(prop-2-en-1-yl)-2H-1,3-benzodioxole; CHEMBL481044; SC-21462; SMR000112534; API0025964; CTK5J3915; HSDB 3516; AC1L1HSS; AN-46392; ZINC403089; DTXSID1025693; FT-0672575; 5-19-02-00631 (Beilstein Handbook Reference); 09237_FLUKA; 5-Allyl-1-methoxy-2,3-(methylenedioxy)benzene; SR-01000838340; NCGC00091427-01 |
| Ingredient_formula: C11H12O3 | Ingredient_Smile: COC1=CC(=CC2=C1OCO2)CC=C |
| Ingredient_weight: 192.21 | OB_score: NA |
| PubChem_id: 4276 | EC: 1.3.1.29 [VIEW IN KEGG] 1.14.12.12 [VIEW IN KEGG] 1.1.1.318 [VIEW IN KEGG] 1.1.1.319 [VIEW IN KEGG] |
| Ingredient_name: palmitoleicacid | Alias: AC1NUU1V; palmitoleic acid; (9Z)-hexadecenoate; cis-Delta(9)-hexadecenoate; zoomarate; (9Z)-hexadec-9-enoate; palmitoleate; (Z)-7-Tetradecenylacetate; (16:1n7); palmitolinoleate; cis-9-hexadecenoate; CHEBI:32372; SECPZKHBENQXJG-FPLPWBNLSA-M; palmitoleic acid (16:1Delta9); (Z)-hexadec-9-enoate |
| Ingredient_formula: C16H30O2 | Ingredient_Smile: CCCCCCC=CCCCCCCCC(=O)O |
| Ingredient_weight: 254.41 g/mol | OB_score: NA |
| PubChem_id: 445638 | EC: 3.1.1.98 [VIEW IN KEGG] 3.1.2.14 [VIEW IN KEGG] |
| Ingredient_name: Palmitone | Alias: AC1L3ST0; ST51047368; HEBTRIACONTANONE; MFCD00059222; AK162853; AI3-22025; EINECS 207-952-8; C-46470; 502-73-8; C08379; palmitone; MolPort-003-906-056; FT-0736780; Hentricontan-16-one; GR7I8IC3NO; Pentadecyl ketone; I14-101307; NSC-953; 16-HEBTRIACONTANONE; LMFA12000005; ZINC8221066; 16-Hentriacontanone; NSC953; CHEBI:5658; UNRFDARCMOHDBJ-UHFFFAOYSA-N; CTK1H0612; ACMC-1AU7I; Hentriacontan-16-one; UNII-GR7I8IC3NO; AKOS024390969; DTXSID00198239; SBB061344; SCHEMBL352951; Dipentadecyl ketone; ANW-30948; TC-119693; MCULE-1539628749; NSC 953 |
| Ingredient_formula: C31H62O | Ingredient_Smile: CCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCC |
| Ingredient_weight: 450.82 | OB_score: 11.85441153 |
| PubChem_id: 94741 | EC: - |
| Ingredient_name: p-cymene | Alias: LMPR0102090014; p-methyl-Cumene; 1-Methyl-4-(1-methylethyl)-benzene; MolPort-003-929-568; Tox21_300338; NSC4162; AC1MR1RS; 20671-17-4; 1-Isopropyl-4-methylbenzene; KSC555A9F; p-Cymene [UN2046] [Flammable liquid]; 1-(1-methylethyl)-4-methylbenzene; 4939-75-7; p-Cymene, analytical standard; 25155-15-1; HFPZCAJZSCWRBC-UHFFFAOYSA-N; 4-Isopropyltoluene; Cymol; DSSTox_GSID_26645; benzene, 1-methyl-4-methylethyl-; Paracymene; 2-(4-METHYLPHENYL)PROPAN-2-YL; p-Mentha-1,3,5-triene; p-Methylcumene; Methyl-4-(1-methylethyl)benzene; F8889-6466; EINECS 202-796-7; 4-methyl isopropyl benzene; Paracymol; bmse000503; 2-p-Tolylpropane; ZB015527; p-Cymene, certified reference material, TraceCERT(R); DSSTox_CID_6645; p-Isopropyltoluene; MFCD00008893; SBB060399; p-Cymene [UN2046] [Flammable liquid]; NCGC00259481-01; FEMA No. 2356; p-Cymene, >=97%, FG; W-100013; p-Cymene, 99%; AJ-24581; p-Isopropylmethylbenzene; InChI=1/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H; ACMC-209sea; para cymene; p- Cymene; 4-Isopropyl-1-methylbenzene; Cumene, p-methyl-; Benzene, 1-methyl-4-(1-methylethyl)-; WLN: 1Y1 & R D1; NCGC00247998-02; p-methyl cumene; AC1L1OTG; DTXSID3026645; Benzene, 1-isopropyl-4-methyl-; Carvacrol derivative, 8; p-Cimene; CYMENE; TR-030492; UNII-830CI19HHD component HFPZCAJZSCWRBC-UHFFFAOYSA-N; NSC 4162; Para-cymene; 99-87-6; PARACYMENE PF; 4-methyl-1-(propan-2-yl)benzene; 4-Isopropylbenzyl radical; CAS-99-87-6; AKOS000121521; Benzene, 1-methyl-4(1-methylethyl)-; p-Isopropyltoluene, analytical standard; CHEMBL442915; 4-Cymene; P- Isopropylmethylbenzene; I14-20073; EC 202-796-7; NCGC00254425-01; AS-11012; 4-iso-Propyltoluene; Dolcymene; Paramethyl-isopropyl-benzene; Camphogen; 4-Isopropyltoluol; BDBM248165; UNII-1G1C8T1N7Q; ANW-41072; 1-Methyl-4-(1-methylethyl)benzene; AK105981; CJ-04640; S0664; 1-Methyl-4-isopropylbenzene; 4-methyl isopropylbenzene; CTK4F5092; AN-24528; DSSTox_RID_78172; CHEBI:28768; NCGC00247998-01; Tox21_201932; p-Methylisopropylbenzene; 1-Methyl-4-isopropyl benzene; NSC-4162; Cymene, p-; 4-Cymol; ZINC968246; 1-methyl-4-(propan-2-yl)benzene; HSDB 5128; 1-methyl-4-propan-2-ylbenzene; P-CYMENE; ST51046586; 1G1C8T1N7Q; KB-192943; FT-0689324; MML; C06575; 4-Methylisopropylbenzene; 4-methyl-1-(methylethyl)benzene; p-Cymol; LS-2649; MCULE-1794861612; BENZENE,1-ISOPROPYL,4-METHYL P-CYMENE; AI3-02272; Benzene,methyl(1-methylethyl)-; 1-isopropyl-4-methyl-Benzene; 4-Methyl-1-isopropylbenzene |
| Ingredient_formula: C10H14 | Ingredient_Smile: CC1=CC=C(C=C1)C(C)C |
| Ingredient_weight: 134.22 | OB_score: NA |
| PubChem_id: 7463 | EC: - |
| Ingredient_name: prunasin | Alias: SMR000470856; CHEMBL1871737; HMS2269N16; MLS000563196 |
| Ingredient_formula: C14H17NO6 | Ingredient_Smile: C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O |
| Ingredient_weight: 295.29 | OB_score: 12.60520752 |
| PubChem_id: 119033 | EC: 2.4.1.354 [VIEW IN KEGG] 3.2.1.21 [VIEW IN KEGG] 3.2.1.117 [VIEW IN KEGG] 3.2.1.118 [VIEW IN KEGG] 2.4.1.220 [VIEW IN KEGG] |
| Ingredient_name: prunetin | Alias: KBio2_006643; CHEBI:8600; Isoflavone, 4',5-dihydroxy-7-methoxy- (7CI,8CI); MFCD00016951; Padmakastein; CHEMBL491174; BIDD:ER0153; LS-39694; ST096009; KBio2_001507; D0A9RM; Spectrum4_001723; 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one; CTK8G2643; SC-66909; Oprea1_083784; BRD-K57546357-001-01-6; KBio1_001533; GTPL6919; FT-0708556; KBioGR_002106; AKOS016010281; 4 inverted exclamation marka,5-Dihydroxy-7-methoxyisoflavone; UNII-1TG4H5H11J; 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-chromen-4-one; Prunetin (6CI); Prunusetin; SCHEMBL73420; 552P590; BSPBio_003044; Spectrum5_000486; ZINC18847044; AJ-70677; 5-18-04-00595 (Beilstein Handbook Reference); MolPort-003-939-175; C-57556; KBio3_002264; 5-Hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one; Y0172; 4',5-dihydroxy-7-methoxygenistein; AK114738; 5,4'-dihydroxy-7-methoxy-isoflavone; 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-chromone; 4H-1-Benzopyran-4-one, 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-; 552-59-0; Spectrum_001027; 7-O-Methyl genistein; AN-45849; 82415_FLUKA; LMPK12050353; KBioSS_001507; EINECS 209-018-5; NCGC00178331-01; 4CN-1042; ST50320097; SMP1_000150; BDBM50359990; AC1NQZ4E; BRN 0292155; 5,4'-dihydroxy-7-methoxyisoflavone; Prunetin, >=98.0% (TLC); ZINC00057630; KQMVAGISDHMXJJ-UHFFFAOYSA-N; C10521; 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one; Prunetin; Spectrum3_001402; SpecPlus_000493; 4',5-dihydroxy-7-methoxyisoflavone; DivK1c_006589; KBio2_004075; prunetin ; 5-Hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4-benzopyrone; 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4-chromenone; 5-Hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one, 9CI; ST5320097; 1TG4H5H11J; CCRIS 8951; AX8092606; 7-O-methyl-genistein; DTXSID3022530 |
| Ingredient_formula: C16H12O5 | Ingredient_Smile: COC1=CC(=C2C(=C1)OC=C(C2=O)C3=CC=C(C=C3)O)O |
| Ingredient_weight: 284.26 g/mol | OB_score: NA |
| PubChem_id: 5281804 | EC: 1.3.1.46 [VIEW IN KEGG] 1.14.14.88 [VIEW IN KEGG] 1.14.14.90 [VIEW IN KEGG] 2.1.1.46 [VIEW IN KEGG] 2.4.1.170 [VIEW IN KEGG] 1.14.13.43 [VIEW IN KEGG] 2.1.1.283 [VIEW IN KEGG] 2.1.1.75 [VIEW IN KEGG] 1.14.19.63 [VIEW IN KEGG] 1.3.1.45 [VIEW IN KEGG] 1.14.14.89 [VIEW IN KEGG] 2.1.1.150 [VIEW IN KEGG] |
| Ingredient_name: rubixanthin | Alias: E161d; CHEBI:8907; LMPR01070281; SCHEMBL43266; 0PWJ89032Q; (all-E,3R)-rubixanthin; C08611; Rubixanthin; g-Caroten-3-ol; 3-Hydroxy-g-carotene; CI 75135; (3R)-beta-4-Caroten-3-ol; (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E)-3,7,12,16,20,24; (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,23-undecaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol; 3763-55-1; E 161d; (3R)-beta,psi-caroten-3-ol; beta-4-Caroten-3-ol, (3R)-; UNII-0PWJ89032Q; ZINC8221265; AC1NQYA3; b,y-Caroten-3-ol; Natural yellow 27 |
| Ingredient_formula: C40H56O | Ingredient_Smile: CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C |
| Ingredient_weight: 552.87 | OB_score: 47.25741915 |
| PubChem_id: 5281252 | EC: 1.14.14.158 [VIEW IN KEGG] 1.14.15.24 [VIEW IN KEGG] 1.14.99.63 [VIEW IN KEGG] 1.14.99.64 [VIEW IN KEGG] |
| Ingredient_name: rubricauloside | Alias: 8-[3-[(2S,3S,6S)-6-[[(2R,3R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,4-trihydroxyoxan-2-yl]oxy-2-hydroxy-3-methylbutyl]-5,7-dimethoxychromen-2-one; AC1O3DX7 |
| Ingredient_formula: C27H38O15 | Ingredient_Smile: CC(C)(C(CC1=C(C=C(C2=C1OC(=O)C=C2)OC)OC)O)OC3C(C(C(C(O3)COC4C(C(CO4)(CO)O)O)O)O)O |
| Ingredient_weight: 602.58 | OB_score: 58.36332151 |
| PubChem_id: 196862 | EC: - |
| Ingredient_name: stearic acid | Alias: 4-02-00-01206 (Beilstein Handbook Reference); AIDS-049230; Emersol 871; 8039-52-9; 126539-56-8; stearic acid, ion(1-); D00119; octadecoic acid; Hydrofol Acid 150 (VAN); 134503-33-6; Fatty acids C16-18; 68937-76-8; Kam 2000; VLZ 200; Lunac S 98; Glycon S-80; Hy-phi 1205; Lunac YA; Pristerene 9429; Pristerene 4900; Octadecanoic acid (9CI); Hystrene 9718NF; Edenor FHTI; Cetylacetic acid; NAA 173; NSC 25956; Lunac S 90; S 30C S 30C (fatty acid); Neo-Fat 18-61; Dar-chem 14; NSC25956; Edenor HT-JG 60; Octadecanoate; 57485-56-0; Oktadekansaeure; S 300 (fatty acid); Unister NAA 180; Industrene 5016; Prisorine 3508; Hydrofol Acid 150; Hystrene 4516; G 270; Stearic Acid Cherry; Century 1230; 822-16-2 (SODIUM SALT); NCGC00091596-02; Glycon S-90; 85404-83-7; NCGC00091596-01; Stearic acid (JP15/NF); Hystrene 5016; Hy-phi 1303; Glycon S-70; C01530; Octadecansaeure; Neo-Fat 18-55; WO 2 (fatty acid); Pristerene 9559; SA 200; Century 1240; Stearic acid, pure; Sunfat 18S; WO 2; CHEBI:28842; Industrene 5016K; LS-2392; Kam 3000; BRN 0608585; Edenor ST 20; AIDS049230; Lunac 30; EINECS 273-087-8; Emersol 150; 175366_SIAL; 8039-54-1; Fatty acids, C16-20; stearicacid; Stearic acid ion(1-)salt; Stearic acid (8CI); Stearinsaeure; Emersol 153NF; Hydrofol acid 1855; 57-11-4; Lunac S 30; Hystrene T 70; Prisorine 3501; Haimaric MKH(R); Stearex Beads; Groco 55; Hystrene S-97; Neo-Fat 18-54; W303518_ALDRICH; Hydrofol acid 1655; Nonsoul SN 1 (*Sodium salt*); EINECS 200-313-4; 39390-61-9; Emersol 120; EPA Pesticide Chemical Code 079082; Lunac S 20; Octadecanoic acid, ion(1-); 8013-28-3; AI3-00909; Kortacid 1895; FEMA No. 3035; Hystrene S 97; 82497-27-6; Tegostearic 254; SNA-2000 (*Sodium salt*); 1-Heptadecanecarboxylic acid; AC1MHWEJ; STL280244; 27405_RIEDEL; Steric acid; Industrene 9018; Glycon dp; F 3 (lubricant); Hy-phi 1401; Lunac S 50; Emersol 132; Stearic acid, ion(1-) (8CI); CH3-[CH2]16-COO(-); acide octadecanoique; Groco 55l; 73297_FLUKA; Serfax MT 90; Stearic acid [USAN:JAN]; 8039-51-8; acide stearique; Kam 1000; Acidum stearinicul; InChI=1/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20; 8039-53-0; 17FA; Stearophanic acid; 8037-83-0; Hystrene 7018; FA 1655; Prisorine 3502; Nonsoul SK 1; Hydrofol Acid 1895; Lunac S 40; Stearic acid 50; 8023-06-1; 85679_FLUKA; HSDB 2000; n-Octadecanoate; 400JB9103-88; Glycon tp; Unimac 5680; Loxiol G 20; Stearate; 875D; Octadecanoic acid; Neo-Fat 18-53; octadecanoate (n-C18:0); Radiacid 0427; Emery 871; Vanicol; Vis-Plus; PD 185; EINECS 250-178-0; AKOS022105769; 646-29-7; Edenor ST 1; S 300; Caswell No. 801D; Selosol 920; Tegostearic 272; Isostearic acid EX; A 1760; WLN: QV17; Stearic acid (TN); Pearl stearic; 609343-71-7; Palmitic acid - stearic acid mixture; Emersol 875; Industrene 8718; Hystrene 9718NFFG; NCGC00164255-02; ST023799; LMFA01010018; Groco 54; Edenor C18; Hystrene T-70; Hy-phi 1199; CTK8J8420; n-Octadecanoic acid; Groco 58; Pristerene 4963; Formula 300; AFCO-Chem B 65; CCRIS 2305; Industrene R; Century 1220; S4751_SIGMA; Neo-Fat 18; 58392-66-8; Barolub FTA; Hystrene 9718; CH3-[CH2]16-COOH; STE; 8037-40-9; 30399-84-9; Lunac S 90KC; Hydrofol 1895; Emery 875D; Century 1210; QIQXTHQIDYTFRH-UHFFFAOYSA-M; Neo-Fat 18-59; LS-1388; Groco 59; Humko Industrene R; Hystrene 80; Adeka Fatty Acid SA 910; Stearic acid; Prifac 2918; Emersol 6349; Edenor C 18/98; 3uex; LS-97707; CHEBI:25629; Neo-Fat 18-S; Stearic acid - palmitic acid mixture; Tegostearic 255; C-Lube 10 |
| Ingredient_formula: CH3(CH2)16COOH | Ingredient_Smile: CCCCCCCCCCCCCCCCCC(=O)O |
| Ingredient_weight: 284.5 g/mol | OB_score: 17.82542938 |
| PubChem_id: 5281 | EC: - |
| Ingredient_name: stearin | Alias: Hardened oil; Stearoyl triglyceride; ACMC-209lnm; KB-259375; 29840-EP2311832A1; propane-1,2,3-triyl trioctadecanoate; triacylglycerol; Tristearin, European Pharmacopoeia (EP) Reference Standard; C57H110O6; AKOS015899779; Octadecanoic acid 1,2,3-Propanetriyl ester; Glyceryl tristearate, 99% 5g; TC-121081; 555-43-1; UNII-P6OCJ2551R; 29840-EP2275408A1; ST24049043; 2,3-Bis(stearoyloxy)propyl stearate #; Dynasan 118; 1,2,3-Propanetriol trioctadecanoate; MFCD00036230; HSDB 5690; MolPort-003-938-618; Kemester 6000 (Salt/Mix); Glycerol tristearate; CHEBI:45956; AN-23684; Stearic acid triglycerin ester; G0212; AI3-01633; LMGL03010002; TGL; EC 209-097-6; AK116949; trioctadecanoylglycerol; Glycerol, trioctadecanoate; Cottonseedoil, hydrogenated; SC-62874; 2,3-di(octadecanoyloxy)propyl octadecanoate; UNII-43AGM4PHPI component DCXXMTOCNZCJGO-UHFFFAOYSA-N; Propane-1,2,3-triyl tristearate; I14-11560; Spezialfett 118; Pationic 919; AC1L1WPM; Glyceryl tristearate, technical; 1,2,3-trioctadecanoyl-glycerol; FT-0675675; Glycowax S 932; TRISTEARIN; 29840-EP2287162A1; 1-stearoyl-2-stearoyl-3-stearoyl-glycerol; DCXXMTOCNZCJGO-UHFFFAOYSA-N; Stearin, tri-; ANW-32336; 1,2,3-Trioctadecanoyl-rac-glycerol; 160170-82-1; Stearic acid triglyceride; TG(18:0/18:0/18:0); Octadecanoic acid, 1,1',1''-(1,2,3-propanetriyl) ester; AS-11714; SCHEMBL9507; 29840-EP2311821A1; KS-00000H8O; Stearin; P6OCJ2551R; 41755-77-5; 1,2,3-Propanetriyl trioctadecanoate; 606967-51-5; 68334-00-9; D10637; Trioctadecanoin; EINECS 209-097-6; Octadecanoic acid, 1,2,3-propanetriyl ester; TRISTEARIN TECHNICAL; Glyceryl tristearate, >=99%; DTXSID8047503; Stearic triglyceride; LS-2391; Glycerol trioctadecanoate; 29840-EP2289868A1; 29840-EP2284169A1; UNII-ZF29F7IK5I component DCXXMTOCNZCJGO-UHFFFAOYSA-N; 29840-EP2311833A1; 29840-EP2287161A1; ZINC85545202; Glyceryl tristearate (NF); Glyceryl tristearate; 1,2,3-trioctadecanoyl-sn-glycerol; TRISTEAROYLGLYCEROL |
| Ingredient_formula: C57H110O6 | Ingredient_Smile: CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC |
| Ingredient_weight: 891.5 g/mol | OB_score: NA |
| PubChem_id: 11146 | EC: - |
| Ingredient_name: terpinolene | Alias: DSSTox_CID_7222; .alpha.- Terpinolen; 1-Methyl-4-(1-methylethylidene)-1-cyclohexene; UNII-N9830X5KSL; Cyclohexene, 3-methyl-6-(1-methylethylidene)- (9CI); .gamma.-Terpinolene; 1-methyl-4-(propan-2-ylidene)cyclohexene; 1,4(8)-Terpadiene; UN2541; 1-Methyl-4-(1-methylethylidene)cyclohexene, 9CI; bmse000504; C06075; alpha -Terpinolene; 1-Methyl-4-(1-methylethylidene)-1-cyclohexene #; Terpinolene Solution, 1000 mg/L, 1 ml (RM, ISO GUIDE 34); AKOS028108377; .alpha.-Terpinolene; 1-Methyl-4-isopropylidene-1-cyclohexene; 1,4(8)-p-Menthadiene; NE11041; ZB015523; ZINC968225; Terpinolene [UN2541] [Flammable liquid]; 1-methyl-4-(1-methylethylidene)-cyclohexene; DSSTox_GSID_27222; 1-methyl-4-propan-2-ylidenecyclohexene; CTK5C9029; DSSTox_RID_78355; 586-62-9; LMPR0102090062; Tox21_303268; Terpinolene [UN2541] [Flammable liquid]; Q-201793; FEMA 3046; EC 209-578-0; N9830X5KSL; Cyclohexene, 1-methyl-4-(1-methylethylidene)-; 1-Methyl-4-(1-methylethylidene)cyclohexene; CHEMBL454697; MFCD00049191; 4-isopropylidene-1-methyl-cyclohexene; 69073-38-7; LS-3108; p-Mentha-1,4(8)-diene; Terpinolene, >=90%; 4-Isopropylidene-1-methylcyclohexene; TR-020377; AI3-24378; Isoterpinene; p-Menth-1,4(8)-diene; TERPINOLENE 95 C; Terpinolene, purum, >=95.0% (GC); 1,4(8)-paramenthadiene; p-Meth-1-en-8-yl-formate; Terpinolene, analytical standard; 1-methyl-4-(propan-2-ylidene)cyclohexene p-mentha-1,4(8)-diene; AN-21504; 1-methyl-4-(propan-2-ylidene)cyclohex-1-ene; delta-Terpinene; 1-METHYL-4-PROPAN-2-YLIDENE-CYCLOHEXENE; CHEBI:9457; Nofmer TP; I14-108647; alpha-Terpinolene; AC1L1XEP; EINECS 209-578-0; FT-0632449; FEMA No. 3046; UN 2541; Tereben; Terpinolen; Terpinolene 95 PFP; 5733AF; FEMA Number 3046; NCGC00256963-01; DTXSID0027222; Terpinolene, technical, >=85% (GC); HSDB 5702; TERPINOLENE; MOYAFQVGZZPNRA-UHFFFAOYSA-N; CAS-586-62-9 |
| Ingredient_formula: C10H16 | Ingredient_Smile: CC1=CCC(=C(C)C)CC1 |
| Ingredient_weight: 136.23 | OB_score: NA |
| PubChem_id: 11463 | EC: 1.14.13.107 [VIEW IN KEGG] 1.14.14.51 [VIEW IN KEGG] 1.14.14.52 [VIEW IN KEGG] 1.14.14.99 [VIEW IN KEGG] 1.17.99.8 [VIEW IN KEGG] 4.2.3.16 [VIEW IN KEGG] 1.14.14.31 [VIEW IN KEGG] 4.2.1.127 [VIEW IN KEGG] 4.2.3.15 [VIEW IN KEGG] 4.2.3.113 [VIEW IN KEGG] 1.14.14.53 [VIEW IN KEGG] 4.2.3.20 [VIEW IN KEGG] 4.2.3.116 [VIEW IN KEGG] 4.2.3.117 [VIEW IN KEGG] 4.2.3.114 [VIEW IN KEGG] 4.2.3.107 [VIEW IN KEGG] 4.2.3.51 [VIEW IN KEGG] 4.2.3.122 [VIEW IN KEGG] 4.2.3.177 [VIEW IN KEGG] 1.14.13.153 [VIEW IN KEGG] 4.2.3.110 [VIEW IN KEGG] 4.2.3.105 [VIEW IN KEGG] 4.2.3.109 [VIEW IN KEGG] 4.2.3.115 [VIEW IN KEGG] 4.2.3.121 [VIEW IN KEGG] 4.2.3.120 [VIEW IN KEGG] 4.2.3.119 [VIEW IN KEGG] 4.2.3.106 [VIEW IN KEGG] |
| Ingredient_name: terpinyl acetate | Alias: TR-037878; KB-60724; ANW-37362; 2,6,6-TRIMETHYL-1,2-BIS({2,6,6-TRIMETHYLBICYCLO[3.1.1]HEPTAN-2-YL})BICYCLO[3.1.1]HEPTANE; ACETIC ACID; terpinylacetate; ACMC-1BKZH; AKOS015837978; RTR-037878; CTK3J2480; KSC492I8B |
| Ingredient_formula: C32H54O2 | Ingredient_Smile: CC(=O)O.CC1(C2CCC(C1C2)(C)C3(CCC4CC3(C4(C)C)C5(CCC6CC5C6(C)C)C)C)C |
| Ingredient_weight: 470.8 g/mol | OB_score: NA |
| PubChem_id: 53472047 | EC: - |
| Ingredient_name: trans-9-trans-12-linoleic acid | Alias: NA |
| Ingredient_formula: NA | Ingredient_Smile: CCCCCCC=CC=CCCCCCCCC(=O)O |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: γ-decanolactone | Alias: NA |
| Ingredient_formula: C10H18O2 | Ingredient_Smile: CCCCCCC1CCC(=O)O1 |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: 1.1.1.241 [VIEW IN KEGG] 1.14.14.133 [VIEW IN KEGG] 1.14.14.84 [VIEW IN KEGG] 1.1.1.297 [VIEW IN KEGG] 3.3.2.8 [VIEW IN KEGG] 1.1.1.324 [VIEW IN KEGG] 1.14.14.83 [VIEW IN KEGG] 1.14.13.105 [VIEW IN KEGG] 3.1.1.83 [VIEW IN KEGG] 1.14.14.56 [VIEW IN KEGG] 2.2.1.12 [VIEW IN KEGG] |
| Ingredient_name: γ-dodecalactone | Alias: NA |
| Ingredient_formula: C12H22O2 | Ingredient_Smile: CCCCCCCCC1CCC(=O)O1 |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: 2.3.1.69 [VIEW IN KEGG] |