Details of Evorine
| IUPAC | (2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6S)-5-hydroxy-4-methoxy-6-[(2R,3R,4S,6S)-4-methoxy-6-[(2R,3R,4S,6R)-4-methoxy-2-methyl-6-[(3S,8R,9S,10R,11S,13S,14S,17S)-11,12,14-trihydroxy-17-[(1R)-1-hydroxyethyl]-10,13-dimethyl-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]oxan-3-yl]oxy-2-methyloxan-3-yl]oxy-2-methyloxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol |
| Canonical Smiles | CC1C(C(CC(O1)C2CCC3(C4C(CC=C3C2)C5(CCC(C5(C(C4O)O)C)C(C)O)O)C)OC)OC6CC(C(C(O6)C)OC7C(C(C(C(O7)C)OC8C(C(C(C(O8)CO)O)O)O)OC)O)OC |
| Inchi | HMUVMTSJOQNAII-UYPPRYDFSA-N |
| PubChem ID | 101210565 |
| Smiles | COC1CC(C2CCC3(C)C(=CCC4C3C(O)C(O)C3(C)C(C(C)O)CCC43O)C2)OC(C)C1OC1CC(OC)C(OC2OC(C)C(OC3OC(CO)C(O)C(O)C3O)C(OC)C2O)C(C)O1 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COC1CC%28C2CCC3%28C%29C%28%3DCCC4C3C%28O%29C%28O%29C3%28C%29C%28C%28C%29O%29CCC43O%29C2%29OC%28C%29C1OC1CC%28OC%29C%28OC2OC%28C%29C%28OC3OC%28CO%29C%28O%29C%28O%29C3O%29C%28OC%29C2O%29C%28C%29O1/file?format=sdf&get3d=True -- COC1CC%28C2CCC3%28C%29C%28%3DCCC4C3C%28O%29C%28O%29C3%28C%29C%28C%28C%29O%29CCC43O%29C2%29OC%28C%29C1OC1CC%28OC%29C%28OC2OC%28C%29C%28OC3OC%28CO%29C%28O%29C%28O%29C3O%29C%28OC%29C2O%29C%28C%29O1 could not be loaded.
| Class | Pregnane steroids |
| Super Class | Steroids |
| Pathways | Terpenoids |