Details of Gagamine
| IUPAC | [(3S,8S,9R,10R,12R,13R,14R,17S)-3,8,14,17-tetrahydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-12-yl] pyridine-3-carboxylate |
| Canonical Smiles | CC([C@@]1(CC[C@]2([C@@]1([C@@H](C[C@H]3[C@]2(CC=C4[C@@]3(CC[C@@H](C4)O)C)O)OC(=O)C5=CN=CC=C5)C)O)O)O |
| Inchi | DRPIMPNUZUSUTN-WNCHUELASA-N |
| PubChem ID | 102005844 |
| Smiles | CC(O)[C@]1(O)CC[C@]2(O)[C@]3(O)CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3C[C@@H](OC(=O)c3cccnc3)[C@]12C |
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| Class | Pregnane steroids |
| Super Class | Steroids |
| Pathways | Terpenoids |