Details of Anguivioside XV
| IUPAC | (3S,8S,9S,10R,13S,14S,17R)-3-[(2R,3R,4S,5S,6R)-4-hydroxy-6-(hydroxymethyl)-3,5-bis[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy]oxan-2-yl]oxy-10,13-dimethyl-17-[(2S,6R)-6-methyl-3-oxo-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptan-2-yl]-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-16-one |
| Canonical Smiles | CC1C(C(C(C(O1)OC2C(OC(C(C2O)OC3C(C(C(C(O3)C)O)O)O)OC4CCC5(C6CCC7(C(C6CC=C5C4)CC(=O)C7C(C)C(=O)CCC(C)COC8C(C(C(C(O8)CO)O)O)O)C)C)CO)O)O)O |
| Inchi | QFMVSVJHRRWVEX-YPRXUKGFSA-N |
| PubChem ID | 10931132 |
| Smiles | CC(CCC(=O)C(C)C1C(=O)CC2C3CC=C4CC(OC5OC(CO)C(OC6OC(C)C(O)C(O)C6O)C(O)C5OC5OC(C)C(O)C(O)C5O)CCC4(C)C3CCC21C)COC1OC(CO)C(O)C(O)C1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC%28CCC%28%3DO%29C%28C%29C1C%28%3DO%29CC2C3CC%3DC4CC%28OC5OC%28CO%29C%28OC6OC%28C%29C%28O%29C%28O%29C6O%29C%28O%29C5OC5OC%28C%29C%28O%29C%28O%29C5O%29CCC4%28C%29C3CCC21C%29COC1OC%28CO%29C%28O%29C%28O%29C1O/file?format=sdf&get3d=True -- CC%28CCC%28%3DO%29C%28C%29C1C%28%3DO%29CC2C3CC%3DC4CC%28OC5OC%28CO%29C%28OC6OC%28C%29C%28O%29C%28O%29C6O%29C%28O%29C5OC5OC%28C%29C%28O%29C%28O%29C5O%29CCC4%28C%29C3CCC21C%29COC1OC%28CO%29C%28O%29C%28O%29C1O could not be loaded.
| Class | |
| Super Class | |
| Pathways |
