Details of 7alpha-Obacunol
| IUPAC | (1S,2R,4S,7S,8S,11R,12R,18R,20R)-7-(furan-3-yl)-20-hydroxy-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-ene-5,15-dione |
| Canonical Smiles | C[C@@]12CC[C@@H]3[C@]4(C=CC(=O)OC([C@@H]4C[C@H]([C@]3([C@@]15[C@H](O5)C(=O)O[C@H]2C6=COC=C6)C)O)(C)C)C |
| Inchi | ADZYDUJXHKLXCN-VXONQGSUSA-N |
| PubChem ID | 102067276 |
| Smiles | CC1(C)OC(=O)C=C[C@@]2(C)[C@H]1C[C@@H](O)[C@]1(C)[C@@H]2CC[C@@]2(C)[C@H](c3ccoc3)OC(=O)C3O[C@]321 |
| Class | Limonoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |