Details of Wallichianol
| IUPAC | (1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-1-[(2S)-1-hydroxypropan-2-yl]-3a,5a,5b,8,8,11a-hexamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol |
| Canonical Smiles | C[C@H](CO)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C |
| Inchi | JUBUMMPZVPLSDN-ULVCUVGISA-N |
| PubChem ID | 101967053 |
| Smiles | C[C@H](CO)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/C%5BC%40H%5D%28CO%29%5BC%40%40H%5D1CC%5BC%40%5D2%28C%29CC%5BC%40%5D3%28C%29%5BC%40H%5D%28CC%5BC%40%40H%5D4%5BC%40%40%5D5%28C%29CC%5BC%40H%5D%28O%29C%28C%29%28C%29%5BC%40%40H%5D5CC%5BC%40%5D43C%29%5BC%40%40H%5D12/file?format=sdf&get3d=True -- C%5BC%40H%5D%28CO%29%5BC%40%40H%5D1CC%5BC%40%5D2%28C%29CC%5BC%40%5D3%28C%29%5BC%40H%5D%28CC%5BC%40%40H%5D4%5BC%40%40%5D5%28C%29CC%5BC%40H%5D%28O%29C%28C%29%28C%29%5BC%40%40H%5D5CC%5BC%40%5D43C%29%5BC%40%40H%5D12 could not be loaded.
| Class | Lupane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |