Details of LIQUIRIDIOLIC ACID
| IUPAC | (2S,3R,4aS,6aS,6bR,9S,10S,12aR,14bR)-3,10-dihydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid |
| Canonical Smiles | CC12CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C1CC(C(C2)O)(C)C(=O)O)C |
| Inchi | ZXWLSOQCDSAYHO-DKLPYYDQSA-N |
| PubChem ID | 131752021 |
| Smiles | CC12CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C1CC(C)(C(=O)O)C(O)C2 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC12CCC3%28C%29C%28%3DCCC4C5%28C%29CCC%28O%29C%28C%29%28CO%29C5CCC43C%29C1CC%28C%29%28C%28%3DO%29O%29C%28O%29C2/file?format=sdf&get3d=True -- CC12CCC3%28C%29C%28%3DCCC4C5%28C%29CCC%28O%29C%28C%29%28CO%29C5CCC43C%29C1CC%28C%29%28C%28%3DO%29O%29C%28O%29C2 could not be loaded.
| Class | Oleanane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |