Details of Isocyasterone
| IUPAC | (3R,4S,5R)-4-[(2R,3R)-2,3-dihydroxy-3-[(2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]butyl]-3,5-dimethyloxolan-2-one |
| Canonical Smiles | CC1C(C(OC1=O)C)CC(C(C)(C2CCC3(C2(CCC4C3=CC(=O)C5C4(CC(C(C5)O)O)C)C)O)O)O |
| Inchi | NEFYSBQJYCICOG-PXPORAFISA-N |
| PubChem ID | 12305324 |
| Smiles | CC1OC(=O)C(C)C1CC(O)C(C)(O)C1CCC2(O)C3=C(CCC12C)C1(C)CC(O)C(O)CC1C(=O)C3 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1OC%28%3DO%29C%28C%29C1CC%28O%29C%28C%29%28O%29C1CCC2%28O%29C3%3DC%28CCC12C%29C1%28C%29CC%28O%29C%28O%29CC1C%28%3DO%29C3/file?format=sdf&get3d=True -- CC1OC%28%3DO%29C%28C%29C1CC%28O%29C%28C%29%28O%29C1CCC2%28O%29C3%3DC%28CCC12C%29C1%28C%29CC%28O%29C%28O%29CC1C%28%3DO%29C3 could not be loaded.
| Class | Ecdysteroids |
| Super Class | Steroids |
| Pathways | Terpenoids |
