Details of THALICOGENIN A1
| IUPAC | (1S,3R,6S,7R,8R,11S,12S,14S,15R,16R)-15-[(1S)-1-[(2S)-5,5-dimethyloxolan-2-yl]ethyl]-7-(hydroxymethyl)-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,14-diol |
| Canonical Smiles | CC(C1CCC(O1)(C)C)C2C(CC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)CO)O)C)C)O |
| Inchi | DFTJVPYGDNTPTD-XDRHZMJUSA-N |
| PubChem ID | 21606557 |
| Smiles | CC(C1CCC(C)(C)O1)C1C(O)CC2(C)C3CCC4C(C)(CO)C(O)CCC45CC35CCC12C |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28C1CCC%28C%29%28C%29O1%29C1C%28O%29CC2%28C%29C3CCC4C%28C%29%28CO%29C%28O%29CCC45CC35CCC12C/file?format=sdf&get3d=True -- CC%28C1CCC%28C%29%28C%29O1%29C1C%28O%29CC2%28C%29C3CCC4C%28C%29%28CO%29C%28O%29CCC45CC35CCC12C could not be loaded.
| Class | Cycloartane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |
