Details of LUPANONE
| IUPAC | (1R,3aR,5aR,5bR,11aS)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-2,3,4,5,6,7,7a,9,10,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysen-11-one |
| Canonical Smiles | CC(C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(C(=O)CCC5(C)C)C)C)C |
| Inchi | NLTVGCSJCAMTNB-NQDHDPTMSA-N |
| PubChem ID | 129730785 |
| Smiles | CC(C)C1CCC2(C)CCC3(C)C(CCC4C5(C)C(=O)CCC(C)(C)C5CCC43C)C12 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28C%29C1CCC2%28C%29CCC3%28C%29C%28CCC4C5%28C%29C%28%3DO%29CCC%28C%29%28C%29C5CCC43C%29C12/file?format=sdf&get3d=True -- CC%28C%29C1CCC2%28C%29CCC3%28C%29C%28CCC4C5%28C%29C%28%3DO%29CCC%28C%29%28C%29C5CCC43C%29C12 could not be loaded.
| Class | Lupane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |