2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-[6-O-[3-oxo-3-[1-O-[2-(4-hydroxyphenyl)-3-(2-O-beta-D-glucopyranosyl-beta-D-glucopyranosyloxy)-4-oxo-5-hydroxy-4H-1-benzopyran-7-yl]-6-C-oxo-2-deoxy-beta-D-glucopyranose-2-yloxy]propanoyl]-3-O-acetyl-beta-D-glucopyranosyloxy]-1-benzopyrylium

Compound Identifiers & Properties

PubChem CID

101056940

SMILES

CC(=O)O[C@H]1[C@@H]([C@H](O[C@H]([C@@H]1O)OC2=C(OC3=CC(=O)C=C(C3=C2)O)C4=CC(=C(C=C4)O)O)COC(=O)CC(=O)O[C@@H]5[C@H]([C@@H]([C@H](O[C@H]5OC6=CC(=C7C(=C6)OC(=C(C7=[OH+])O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)C1=CC=C(C=C1)O)O)C(=O)O)O)O)O

Canonical SMILES

CC(=O)O[C@@H]1[C@@H](O)[C@H](Oc2cc3c(O)cc(=O)cc-3oc2-c2ccc(O)c(O)c2)O[C@H](COC(=O)CC(=O)O[C@H]2[C@H](Oc3cc(O)c4c(=[OH+])c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(-c5ccc(O)cc5)oc4c3)O[C@H](C(=O)O)[C@@H](O)[C@@H]2O)[C@H]1O