Details of Pueroside-A
| IUPAC | (3Z)-9-hydroxy-4-(4-hydroxyphenyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-5,6-dihydro-1-benzoxocin-2-one |
| Canonical Smiles | CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3CC4=C(C=C(C=C4)O)OC(=O)C=C3C5=CC=C(C=C5)O)O)O)O)O)O)O |
| Inchi | LRFHJRYHICUNML-WAHMGNLFSA-N |
| PubChem ID | 145874208 |
| Smiles | CC1OC(OCC2OC(OC3=C(c4ccc(O)cc4)CC(=O)Oc4cc(O)ccc4C3)C(O)C(O)C2O)C(O)C(O)C1O |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/CC1OC%28OCC2OC%28OC3%3DC%28c4ccc%28O%29cc4%29CC%28%3DO%29Oc4cc%28O%29ccc4C3%29C%28O%29C%28O%29C2O%29C%28O%29C%28O%29C1O/file?format=sdf&get3d=True -- CC1OC%28OCC2OC%28OC3%3DC%28c4ccc%28O%29cc4%29CC%28%3DO%29Oc4cc%28O%29ccc4C3%29C%28O%29C%28O%29C2O%29C%28O%29C%28O%29C1O could not be loaded.
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