Details of Cucurbitacin
| IUPAC | [6-(2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxoheptan-2-yl] acetate |
| Canonical Smiles | CC(=O)OC(C)(C)CCC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(=O)C4(C)C)O)C)C)C)O)O |
| Inchi | QZJJDOYZVRUEDY-UHFFFAOYSA-N |
| PubChem ID | 588303 |
| Smiles | CC(=O)OC(C)(C)CCC(=O)C(C)(O)C1C(O)CC2(C)C3CC=C4C(CC(=O)C(O)C4(C)C)C3(C)C(=O)CC12C |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28%3DO%29OC%28C%29%28C%29CCC%28%3DO%29C%28C%29%28O%29C1C%28O%29CC2%28C%29C3CC%3DC4C%28CC%28%3DO%29C%28O%29C4%28C%29C%29C3%28C%29C%28%3DO%29CC12C/file?format=sdf&get3d=True -- CC%28%3DO%29OC%28C%29%28C%29CCC%28%3DO%29C%28C%29%28O%29C1C%28O%29CC2%28C%29C3CC%3DC4C%28CC%28%3DO%29C%28O%29C4%28C%29C%29C3%28C%29C%28%3DO%29CC12C could not be loaded.
| Class | Cucurbitane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |