Details of Borapetol B
| IUPAC | methyl (2S,4aS,6S,6aR,9R,10aS,10bS)-2-(furan-3-yl)-6,9-dihydroxy-6a,10b-dimethyl-4-oxo-1,2,4a,5,6,9,10,10a-octahydrobenzo[f]isochromene-7-carboxylate |
| Canonical Smiles | C[C@@]12C[C@H](OC(=O)[C@H]1C[C@@H]([C@@]3([C@H]2C[C@H](C=C3C(=O)OC)O)C)O)C4=COC=C4 |
| Inchi | WMFCEJSQHFTWJN-WLLNXKAUSA-N |
| PubChem ID | 21636044 |
| Smiles | COC(=O)C1CC(=O)C[C@H]2[C@]3(C)C[C@@H](c4ccoc4)OC(=O)C3C[C@H](O)[C@@]12C |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COC%28%3DO%29C1CC%28%3DO%29C%5BC%40H%5D2%5BC%40%5D3%28C%29C%5BC%40%40H%5D%28c4ccoc4%29OC%28%3DO%29C3C%5BC%40H%5D%28O%29%5BC%40%40%5D12C/file?format=sdf&get3d=True -- COC%28%3DO%29C1CC%28%3DO%29C%5BC%40H%5D2%5BC%40%5D3%28C%29C%5BC%40%40H%5D%28c4ccoc4%29OC%28%3DO%29C3C%5BC%40H%5D%28O%29%5BC%40%40%5D12C could not be loaded.
| Class | Colensane and Clerodane diterpenoids |
| Super Class | Diterpenoids |
| Pathways | Terpenoids |
