Details of Theasinensin A
IUPAC | [(2R,3R)-2-[2-[6-[(2R,3R)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-3,4-dihydro-2H-chromen-2-yl]-2,3,4-trihydroxyphenyl]-3,4,5-trihydroxyphenyl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate |
Canonical Smiles | C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3C4=C(C(=C(C=C4C5C(CC6=C(C=C(C=C6O5)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)O)O)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O |
Inchi | YUULFXAQUWEYNP-GXAWFILRSA-N |
PubChem ID | 442543 |
Smiles | CCC=CCC1C(=O)CCC1CC(=O)OC |
Class | Flavan-3-ols, Proanthocyanins |
Super Class | Flavonoids |
Pathways | Shikimates and Phenylpropanoids |