Details of CLERODENDRIN C
| IUPAC | [(1R,2S,3R,4aR,5S,6R,8S,8aR)-5-[(3aS,5S,6aS)-3a,4,5,6a-tetrahydrofuro[2,3-b]furan-5-yl]-8-acetyloxy-8a-(acetyloxymethyl)-3-hydroxy-5,6-dimethylspiro[3,4,4a,6,7,8-hexahydro-2H-naphthalene-1,2'-oxirane]-2-yl] 2-acetyloxy-2-methylpropanoate |
| Canonical Smiles | CC1CC(C2(C(C1(C)C3CC4C=COC4O3)CC(C(C25CO5)OC(=O)C(C)(C)OC(=O)C)O)COC(=O)C)OC(=O)C |
| Inchi | ROLHZNATRGMXKR-LUYCMFIRSA-N |
| PubChem ID | 76316104 |
| Smiles | CC(=O)OCC12C(OC(C)=O)CC(C)C(C)(C3CC4C=COC4O3)C1CC(O)C(OC(=O)C(C)(C)OC(C)=O)C21CO1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28%3DO%29OCC12C%28OC%28C%29%3DO%29CC%28C%29C%28C%29%28C3CC4C%3DCOC4O3%29C1CC%28O%29C%28OC%28%3DO%29C%28C%29%28C%29OC%28C%29%3DO%29C21CO1/file?format=sdf&get3d=True -- CC%28%3DO%29OCC12C%28OC%28C%29%3DO%29CC%28C%29C%28C%29%28C3CC4C%3DCOC4O3%29C1CC%28O%29C%28OC%28%3DO%29C%28C%29%28C%29OC%28C%29%3DO%29C21CO1 could not be loaded.
| Class | Colensane and Clerodane diterpenoids |
| Super Class | Diterpenoids |
| Pathways | Terpenoids |