Details of Apioglycyrrhizin
| IUPAC | 6-[(11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl)oxy]-5-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid |
| Canonical Smiles | CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(CO5)(CO)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C |
| Inchi | RETHOWGCGNZYSL-UHFFFAOYSA-N |
| PubChem ID | 195343 |
| Smiles | CC1(C(=O)O)CCC2(C)CCC3(C)C(=C2C1)CC(=O)C1C2(C)CCC(OC4OC(C(=O)O)C(O)C(O)C4OC4OCC(O)(CO)C4O)C(C)(C)C2CCC13C |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1%28C%28%3DO%29O%29CCC2%28C%29CCC3%28C%29C%28%3DC2C1%29CC%28%3DO%29C1C2%28C%29CCC%28OC4OC%28C%28%3DO%29O%29C%28O%29C%28O%29C4OC4OCC%28O%29%28CO%29C4O%29C%28C%29%28C%29C2CCC13C/file?format=sdf&get3d=True -- CC1%28C%28%3DO%29O%29CCC2%28C%29CCC3%28C%29C%28%3DC2C1%29CC%28%3DO%29C1C2%28C%29CCC%28OC4OC%28C%28%3DO%29O%29C%28O%29C%28O%29C4OC4OCC%28O%29%28CO%29C4O%29C%28C%29%28C%29C2CCC13C could not be loaded.
| Class | Oleanane triterpenoids |
| Super Class | Triterpenoids |
| Pathways | Terpenoids |
