Details of SPATHODIC ACID
| IUPAC | (1S,4aR,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-1,10-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Canonical Smiles | CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1O)C)C(=O)O)C |
| Inchi | TUOYZAJHBIXONX-CGSJAQJOSA-N |
| PubChem ID | 21594148 |
| Smiles | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1%28C%29CCC2%28C%28%3DO%29O%29CCC3%28C%29C%28%3DCCC4C5%28C%29CCC%28O%29C%28C%29%28CO%29C5CCC43C%29C2C1O/file?format=sdf&get3d=True -- CC1%28C%29CCC2%28C%28%3DO%29O%29CCC3%28C%29C%28%3DCCC4C5%28C%29CCC%28O%29C%28C%29%28CO%29C5CCC43C%29C2C1O could not be loaded.
| Class | Oleanane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |