| Compound | Psychotrine |
| NPACT-Id | NPACT01302 |
| IUPAC | - |
| Synonyms | 1',15-Didehydro-7',10,11-trimethoxyemetan-6'-ol;1',2'-Didehydro-7',10,11-trimethoxyemetan-6'-ol;Emetan-6'-ol, 1',2'-didehydro-7',10,11-trimethoxy-;1-[[(2R,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-7-methoxy-3,4-dihydro-2H-isoquinolin-6-one;7633-29-6 |
| PubChem Id | 15560508 |
| Class | Alkaloids |
| In-vitro anticancer activity | 8 cancer cell lines |
| In-Vivo anticancer activity | No |
| Targets | No targets found |
| Properties | Physical Elemental Topological |
| InChi Key | FBRKYRSUSJWLHH-UHFFFAOYSA-N |
| InChi | 1S/C29H38N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,25H,6-12,17H2,1-5H3 |
| SMILES | O(c1cc2C3N(CC(C(C3)CC3=NCCc4c3cc(OC)c(OC)c4)CC)CCc2cc1OC)C |
|
SMART | [#6]CC1CN2CCC3=CC(O[#6])=C(O[#6])C=C3C2CC1CC1=NCCC2=CC(O[#6])=C(O[#6])C=C12 |
| CAS No. | 7633-29-6 |
|
Structure
Download | 
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| Cross Refrence in other databases |
| Super Natural | - |
| CTD | C116895 |
| HIT | - |
| NCI-60 GI50 data | - |
| Suppliers | NA, |
| Drug-Likeliness Filters | Lipinski's rule of five | Yes |
| Ghose filter | No |
| Veber filter | Yes |
| Muegge Filter | Yes |
| Similarity Search | Human metabolite database | FDA approved drugs |