Summary
| Herb Id: TCMCG041 | Herb name: Nelumbo nucifera |
| Function: To supplement spleen and check diarrhea, boost kidney and secure essence, nourish heart and quiet spirit. | Indication: Chronic diarrhea, inappetence, emission, restlessness, fright palpitation, insomnia, flooding and spotting, excessive leukorrhea. |
Ingredient
| Ingredient_name: anonaine | Alias: C09339; 3,5-DIOXA-11-AZAPENTACYCLO[10.7.1.0(2),?.0?,(2)?.0(1)?,(1)?]ICOSA-1(20),2(6),7,14,16,18-HEXAENE; 1862-41-5; SCHEMBL15800852; 3,5-dioxa-11-azapentacyclo[10.7.1.0;{2,6}.0;{8,20}.0;{14,19}]icosa-1(20),2(6),7,14(19),15,17-hexaene; 1,2-Methylenedioxynoraporphine; Anonaine; J3.604.525F; Anonain; ACon1_001472; NCGC00180471-01; AC1MR46Q; (-)-Annonaine; 5H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinoline, 6,7,7a,8-tetrahydro-, (R)-; (+)-Anonaine |
| Ingredient_formula: C17H15NO2 | Ingredient_Smile: C1CNC2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5 |
| Ingredient_weight: 265.31 | OB_score: 25.1408525 |
| PubChem_id: 160597 | EC: - |
| Ingredient_name: Armepavine | Alias: TimTec1_005225; AC1LE4QO; CHEMBL1186477; armepavine; 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenol; UNII-8A0GW472W3 component ZBKFZIUKXTWQTP-KRWDZBQOSA-N; 14400-96-5; LS-193195; ZINC44853; Phenol, 4-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)-, (S)-; UNII-28W0AOI5PG; 524-20-9; Phenol, 4-(((1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)-; (+)-Armepavine; 1alphaH-Armepavine; Armepavine, (+)-; STOCK1N-04340; L-(+)-Armepavine; 28W0AOI5PG; 4-[[(1S)-1,2,3,4-Tetrahydro-6,7-dimethoxy-2-methylisoquinolin-1-yl]methyl]phenol; C09342; S-(+)-Armepavine; 4-[[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenol |
| Ingredient_formula: C19H23NO3 | Ingredient_Smile: CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)OC |
| Ingredient_weight: 313.39 | OB_score: 69.3090586 |
| PubChem_id: 680292 | EC: - |
| Ingredient_name: catechol | Alias: 430749_ALDRICH; Catechin (phenol); Pyrokatechin [Czech]; NCGC00015283-01; Catechol-UL-14C; NCI-C55856; CI Oxidation Base 26; CHEBI:18135; benzene-1,2-diol; C15571; 120-80-9; InChI=1/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8; C9510_SIAL; Fouramine PCH; 135011_SIAL; Lopac-C-9510; 2-hydroxyphenol; NSC 1573; NCGC00091262-01; Fourrine 68; o-Diphenol; C.I. Oxidation Base 26; o-Dioxybenzene; C00090; ST5214346; (1,2,3,4,5,6-(1)?C?)BENZENE-1,2-DIOL; AB-131/40235236; Lopac0_000280; ortho-Benzenediol; Catechol (phenol); ortho-Hydroquinone; ZINC00330145; 16474-90-1; pyrocatechol; benzenediol; Brenzcatechin; 12385-08-9; C01785; EINECS 204-427-5; EU-0100280; nchembio801-comp10; o-Dihydroxybenzene; Durafur Developer CFouramine PCH; o-Hydroxyphenol; Phthalhydroquinone; 16474-89-8; Catechol-pyrocatechol; CCRIS 741; ACM19481108; AI3-03995; Pyrocatechinic acid; CI 76500; Durafur developer C; o-Phenylenediol; 1,2-dihydroxybenzene; ortho-Hydroxyphenol; Oxyphenic acid; BRN 0471401; c0097; pyrocatechol-ul-14C; CAQ; 37349-32-9; ortho-Dihydroxybenzene; AIDS-108194; C3561_SIAL; o-Benzenediol; ortho-Dioxybenzene; Katechol [Czech]; Pelagol Grey C; Pyrokatechol [Czech]; AIDS108194; Pyrocatechinic acidPyrocatechol; WLN: QR BQ; Pyrocatechine; 1,2-benzenediol; o-Hydroquinone; CATECHOL; Benzene, o-dihydroxy-; pyrocatechin; ortho-Phenylenediol; HSDB 1436; C9593_SIGMA; NSC1573; C.I. 76500 |
| Ingredient_formula: C6H6O2 | Ingredient_Smile: C1=CC=C(C(=C1)O)O |
| Ingredient_weight: 110.11 | OB_score: 29.86070108 |
| PubChem_id: 289 | EC: 1.1.3.14 [VIEW IN KEGG] 1.3.1.19 [VIEW IN KEGG] 1.3.1.20 [VIEW IN KEGG] 1.3.1.25 [VIEW IN KEGG] 1.10.3.1 [VIEW IN KEGG] 1.13.11.1 [VIEW IN KEGG] 1.13.11.2 [VIEW IN KEGG] 1.14.12.1 [VIEW IN KEGG] 1.14.12.13 [VIEW IN KEGG] 1.14.12.23 [VIEW IN KEGG] 1.14.13.1 [VIEW IN KEGG] 1.14.13.7 [VIEW IN KEGG] 1.14.13.31 [VIEW IN KEGG] 1.14.13.244 [VIEW IN KEGG] 1.14.14.20 [VIEW IN KEGG] 1.14.18.1 [VIEW IN KEGG] 2.1.1.6 [VIEW IN KEGG] 4.1.1.46 [VIEW IN KEGG] 4.1.1.63 [VIEW IN KEGG] 1.6.5.6 [VIEW IN KEGG] 1.8.5.7 [VIEW IN KEGG] 1.13.11.66 [VIEW IN KEGG] 1.14.13.64 [VIEW IN KEGG] 2.4.1.218 [VIEW IN KEGG] 3.1.1.2 [VIEW IN KEGG] 3.2.1.86 [VIEW IN KEGG] 4.1.1.62 [VIEW IN KEGG] 1.14.13.219 [VIEW IN KEGG] 1.14.13.220 [VIEW IN KEGG] 1.14.14.27 [VIEW IN KEGG] 4.1.1.103 [VIEW IN KEGG] 1.10.3.2 [VIEW IN KEGG] |
| Ingredient_name: Catharanthamine | Alias: catharanthamine |
| Ingredient_formula: C46H56N4O9 | Ingredient_Smile: CCC12CC3CN(C1)CCC4=C(C(C3O2)(C5=C(C=C6C(=C5)C78CCN9C7C(C=CC9)(C(C(C8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)NC1=CC=CC=C41 |
| Ingredient_weight: 808.96 | OB_score: 12.53112321 |
| PubChem_id: 156951 | EC: - |
| Ingredient_name: demethylcoclaurine | Alias: demethyl coclaurine |
| Ingredient_formula: C16H17NO3 | Ingredient_Smile: C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O |
| Ingredient_weight: 271.31 g/mol | OB_score: NA |
| PubChem_id: 114840 | EC: 2.1.1.128 [VIEW IN KEGG] 4.2.1.78 [VIEW IN KEGG] 1.14.14.1 [VIEW IN KEGG] 1.14.19.50 [VIEW IN KEGG] |
| Ingredient_name: higenamine | Alias: UNII-6016M93W29; CHEBI:27751; (R)-Norcoclaurine; 6,7-Dihydroxy-(1R)-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline; 6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-((4-hydroxyphenyl)methyl)-, (1R)-; (1R)-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol; 6016M93W29; SCHEMBL5898913; AX8328517; DTXSID90331552; (+)-HIGENAMINE; UNII-TBV5O16GAP component WZRCQWQRFZITDX-CQSZACIVSA-N; CHEMBL501778; 6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-((4-hydroxyphenyl)methyl)-, (R)-; C06347; (R)-(+)-Higenamine; (+)-Demethylcoclaurine; 106032-53-5; BDBM50242856; AC1L9ACA; (1R)-1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol; AK00743742; (R)-1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol; Higenamine, (+)-; ZINC896041 |
| Ingredient_formula: C16H17NO3 | Ingredient_Smile: C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O |
| Ingredient_weight: 271.31 | OB_score: NA |
| PubChem_id: 114840 | EC: 2.1.1.128 [VIEW IN KEGG] 4.2.1.78 [VIEW IN KEGG] 1.14.14.1 [VIEW IN KEGG] 1.14.19.50 [VIEW IN KEGG] |
| Ingredient_name: hildecarpin | Alias: NA |
| Ingredient_formula: C17H14O7 | Ingredient_Smile: COC1=C(C=C2C(=C1)C3C(CO2)(C4=CC5=C(C=C4O3)OCO5)O)O |
| Ingredient_weight: 330.29 g/mol | OB_score: NA |
| PubChem_id: 442773 | EC: 2.1.1.82 [VIEW IN KEGG] 2.1.1.83 [VIEW IN KEGG] 1.21.3.4 [VIEW IN KEGG] 1.21.3.5 [VIEW IN KEGG] 2.1.1.169 [VIEW IN KEGG] 2.1.1.175 [VIEW IN KEGG] |
| Ingredient_name: isoliensinine | Alias: 7-Isoquinolinol, 1,2,3,4-tetrahydro-1-((4-hydroxy-3-((1,2,3,4-tetrahydro-6-methoxy-1-((4-methoxyphenyl)methyl)-2-methyl-7-isoquinolinyl)oxy)phenyl)methyl)-6-methoxy-2-methyl-, (R-(R*,R*))-; 1-{[4-hydroxy-3-({6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenyl]methyl}-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol; (1R)-1-[4-hydroxy-3-[[(1R)-6-methoxy-1-(4-methoxybenzyl)-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]benzyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol; Isoliensinine; Isoliensinin; 6817-41-0; (1R)-1-[[4-hydroxy-3-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol; 7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[[4-hydroxy-3-[[(1R)-1,2,3,4-tetrahydro-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-7-isoquinolinyl]oxy]phenyl]methyl]-6-methoxy-2-methyl-, (1R)-; AIDS-226951; AIDS226951 |
| Ingredient_formula: C37H42N2O6 | Ingredient_Smile: CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)O)OC |
| Ingredient_weight: 610.74 | OB_score: 2.43571236 |
| PubChem_id: 5274591 | EC: - |
| Ingredient_name: liensinine | Alias: 2586-96-1; Lien; AIDS226949; Phenol, 4-[[(1R)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]-2-[[(1R)-1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-7-isoquinolinyl]oxy]-; Liensinine; 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-1-(4-hydroxybenzyl)-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol; 4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol; Phenol, 4-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)-2-((1,2,3,4-tetrahydro-1-((4-hydroxyphenyl)methyl)-6-methoxy-2-methyl-7-isoquinolinyl)oxy)-, (R-(R*,R*))-; 4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-2-({1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenol; AIDS-226949 |
| Ingredient_formula: C37H42N2O6 | Ingredient_Smile: CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC |
| Ingredient_weight: 610.74 | OB_score: NA |
| PubChem_id: 160644 | EC: - |
| Ingredient_name: lignoceric acid | Alias: tetracosoic acid; 46927-71-3; LMFA01010024; tetracosanoate; CHEBI:28866; n-tetracosanoate; Lignoceric acid; 87110_FLUKA; L6641_SIGMA; 557-59-5; tetracosanate; EINECS 209-180-7; C08320; DTXSID80420121; Tetracosanoic acid; AC1NUU2A; N-TETRACOSANOIC ACID; Lignozerinsaeure; lignocericacid; Tetracosanoat; CH3-[CH2]22-COO(-); tetracosoate; tetraeicosanoate; lignocerate; Lignocerat; CHEBI:31014; CH3-[CH2]22-COOH |
| Ingredient_formula: C24H48O2 | Ingredient_Smile: CCCCCCCCCCCCCCCCCCCCCCCC(=O)O |
| Ingredient_weight: 368.64 | OB_score: 14.9035593 |
| PubChem_id: 11197 | EC: - |
| Ingredient_name: liriodenine | Alias: Micheline B; CCRIS 1549; Oxoushinsunin; C09567; NSC-93681; 475-75-2; 8H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinolin-8-one; Spermatheridin; DTXSID40197165; 3,5-DIOXA-11-AZAPENTACYCLO[10.7.1.0(2),?.0?,(2)?.0(1)?,(1)?]ICOSA-1,6,8,10,12(20),14,16,18-OCTAEN-13-ONE; SCHEMBL165803; Noraporphin-7-one,5,6,6a-tetradehydro-1,2-(methylenedioxy)-; MEGxp0_001521; NSC-215254; NCI60_001798; BRN 0273167; MUMCCPUVOAUBAN-UHFFFAOYSA-N; 8H-Benzo[g]-1,5,4-de]quinolin-8-one; FT-0698453; Hiriodenine; Spermatheridine; Noraporphin-7-one, 4,5,6,6a-tetradehydro-1,2-(methylenedioxy)-; liriodenine ; 8H-[1,3]Benzodioxolo[6,5,4-de]benzo[g]quinolin-8-one; AKOS028108460; 8H-Benzo[g]-1,3benzodioxolo[6,5,4-de]quinolin-8-one; AC1L1UL2; NSC93681; 8h-1,3-benzodioxolo[6,5,4-de]benzo[g]quinolin-8-one; CHEBI:70649; LS-97039; NSC215254; CTK1D5811; E134R7X4O9; Liriodenine; Oxoushinsunine; BDBM50202301; CHEMBL37736; NSC 215254; UNII-E134R7X4O9; 8H-Benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-8-one; Ushinsunine, oxo-; ZINC6256; MolPort-005-981-187; 8H-Benzo(g)-1,3-benzodioxolo(6,5,4-de)quinolin-8-one (9CI); AK-693/21087012; NSC 93681; NCI60_042088; AC1Q6OS6; 4-27-00-06585 (Beilstein Handbook Reference); 8H-[1,3]Benzodioxolo[6,5,4-de]benzo[g]quinolin-8-one #; 4CN-1565 |
| Ingredient_formula: C17H9NO3 | Ingredient_Smile: C1OC2=C(O1)C3=C4C(=C2)C=CN=C4C(=O)C5=CC=CC=C53 |
| Ingredient_weight: 275.26 g/mol | OB_score: NA |
| PubChem_id: 10144 | EC: - |
| Ingredient_name: neferine | Alias: Nef; 4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-[[6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol; Neferine; 12'-O-Methylliensinine; AC1L9HBD; CHEMBL1986816; 4-[(6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-2-({6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenol; NSC708929; NCI60_038489; NSC-708929; CTK7A3596 |
| Ingredient_formula: C38H44N2O6 | Ingredient_Smile: CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC |
| Ingredient_weight: 624.77 | OB_score: NA |
| PubChem_id: 134693217 | EC: - |
| Ingredient_name: n-norarmepavine | Alias: NA |
| Ingredient_formula: NA | Ingredient_Smile: COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)OC |
| Ingredient_weight: NA | OB_score: NA |
| PubChem_id: NA | EC: - |
| Ingredient_name: n-nornuciferine | Alias: NA |
| Ingredient_formula: C18H19NO2 | Ingredient_Smile: COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC |
| Ingredient_weight: 281.35 | OB_score: 22.52578839 |
| PubChem_id: 12313579 | EC: - |
| Ingredient_name: Norathyriol | Alias: 1,3,6,7-tetrahydroxy-9-xanthenone; DTXSID30188901; 1,3,6,7-Tetrahydroxyxanthen-9-one; SCHEMBL2418732; ACN-049134; NP-005102; AKOS028108772; norathyriol ; W2659; AIDS011168; 1,3,6,7-Tetrahydroxyxanthone; AIDS-011168; 3542-72-1; 1,3,6,7-Tetrahydroxyxanthonin; norathyriol; AC1NQYTS; MolPort-001-741-798; 58383-15-6; BG00966136; 9H-Xanthen-9-one, 1,3,6,7-tetrahydroxy-; 1,3,6,7-Tetrahydroxy-xanthen-9-one; 4CN-2425; ZINC6090922; 2,4,6,7-Tetrahydroxyxanthone; CHEBI:7622; CHEMBL187265; BDBM50155447; C10086; NRA; 1,3,6,7-Tetrahydroxyxantone; 1,3,6,7-TETRAHYDROXY-9H-XANTHEN-9-ONE; MCULE-4986517729; 9H-Xanthen-9-one,1,3,6,7-tetrahydroxy- |
| Ingredient_formula: C13H8O6 | Ingredient_Smile: C1=C(C=C2C(=C1O)C(=O)C3=CC(=C(C=C3O2)O)O)O |
| Ingredient_weight: 260.2 | OB_score: 18.35312405 |
| PubChem_id: 5281656 | EC: - |
| Ingredient_name: norobtusifolin | Alias: 1,2,8-Trihydroxy-3-methyl-9,10-anthracenedione, 9CI; 2,5-DICHLOROPHENYL DICHLOROPHOSPHATE, 97; 1,2,8-Trihydroxy-3-methylanthraquinone; 2-Hydroxychrysophanol; Norobtusifolin; CHEMBL190245; ZINC4098690; CTK5A8153; 9,10-Anthracenedione,1,2,8-trihydroxy-3-methyl-; AK385973; C10379; 1,2,8-trihydroxy-3-methylanthracene-9,10-dione; AC-10899; 9,10-Anthracenedione, 1,2,8-trihydroxy-3-methyl-; 58322-78-4; LMPK13040011; DTXSID70207049; 1,2,8-trihydroxy-3-methyl-9,10-anthraquinone; AC1L9DD2; CHEBI:7635; AKOS015960424; SCHEMBL3192604 |
| Ingredient_formula: C15H10O5 | Ingredient_Smile: CC1=CC2=C(C(=C1O)O)C(=O)C3=C(C2=O)C=CC=C3O |
| Ingredient_weight: 270.24 g/mol | OB_score: NA |
| PubChem_id: 442759 | EC: 1.14.14.81 [VIEW IN KEGG] 1.14.14.82 [VIEW IN KEGG] 1.14.19.76 [VIEW IN KEGG] 1.14.20.5 [VIEW IN KEGG] 2.1.1.75 [VIEW IN KEGG] 2.4.1.81 [VIEW IN KEGG] 1.3.1.51 [VIEW IN KEGG] 1.14.14.90 [VIEW IN KEGG] 2.1.1.46 [VIEW IN KEGG] 2.1.1.150 [VIEW IN KEGG] 2.4.1.170 [VIEW IN KEGG] 3.2.1.21 [VIEW IN KEGG] 4.2.1.105 [VIEW IN KEGG] 2.4.1.253 [VIEW IN KEGG] 3.2.1.167 [VIEW IN KEGG] 1.14.20.6 [VIEW IN KEGG] 2.1.1.283 [VIEW IN KEGG] |
| Ingredient_name: nuciferine | Alias: AC1MP6HA |
| Ingredient_formula: C19H21NO2 | Ingredient_Smile: CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)OC |
| Ingredient_weight: 295.4 g/mol | OB_score: NA |
| PubChem_id: 10146 | EC: - |
| Ingredient_name: Nudicauline | Alias: nudicauline |
| Ingredient_formula: C38H50N2O11 | Ingredient_Smile: CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC(=O)C)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N8C(=O)CC(C8=O)C |
| Ingredient_weight: 710.81 | OB_score: 41.26767484 |
| PubChem_id: 101631701 | EC: - |
| Ingredient_name: Oxyacanthine | Alias: STOCK1N-30778; C09598; 518-92-3; NSC93135; oxyacanthine; CHEMBL510022; 548-40-3; Repandine; CHEBI:7853; (-)-repandine; ZINC42850970 |
| Ingredient_formula: C37H40N2O6 | Ingredient_Smile: CN1CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=CC(=C(C=C7CCN6C)OC)O3)O)OC)OC |
| Ingredient_weight: 608.72 | OB_score: 9.905148706 |
| PubChem_id: 10031631 | EC: - |
| Ingredient_name: pronuciferine | Alias: N,O-Dimethylcrotsparine; Spiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopent[ij]isoquinolin]-4-one, 2',3',8',8'a-tetrahydro-5',6'-dimethoxy-1'-methyl-, (R)-; (-)-Pronuciferine; UNII-RPT0IU7P8P; AC1LGFBN; WUYQEGNOQLRQAQ-AWEZNQCLSA-N; RPT0IU7P8P; ZINC19884529; 6aalpha-Pronuciferine |
| Ingredient_formula: C19H21NO3 | Ingredient_Smile: CN1CCC2=CC(=C(C3=C2C1CC34C=CC(=O)C=C4)OC)OC |
| Ingredient_weight: 311.4 g/mol | OB_score: NA |
| PubChem_id: 200480 | EC: 1.14.11.31 [VIEW IN KEGG] 1.14.11.32 [VIEW IN KEGG] 4.2.99.24 [VIEW IN KEGG] |
| Ingredient_name: propanethial s-oxide | Alias: OI55X42ZZH; E-Propanethial S-oxide; UNII-OI55X42ZZH; Propanethial S-oxide, Z-; (z)-propanethial s-oxide; Thiopropanal sulfoxide; Propanethial S-oxide E-isomer; Propanethial S-oxide; Propanethial, S-oxide, (1E)-; lachrymatory factor; propanethials-oxide; Propanethial S-oxide Z-isomer; 94Z73U61UH; Z-Propanethial S-oxide; AC1L9B9S; Syn-Propanethial-S-oxide; UNII-TLN93NUR7S; 1-sulfinylidenepropane; Thial-1-Propene-1-thiol S-oxide; Propanethial, S-oxide, (1Z)-; Propanethial S-oxide, (1E)-; BAZSXBOAXJLRNH-UHFFFAOYSA-N; 32157-29-2; 1-sulfinylpropane; UNII-94Z73U61UH; 1-sulfinyl-propane; 70565-74-1; Propanethial, S-oxide; 74635-27-1; InChI=1/C3H6OS/c1-2-3-5-4/h3H,2H2,1H; CHEBI:8475; TLN93NUR7S; Thiopropanal S-oxide; C08389 |
| Ingredient_formula: C3H6OS | Ingredient_Smile: CCC=S=O |
| Ingredient_weight: 90.15 g/mol | OB_score: NA |
| PubChem_id: 441491 | EC: - |