theaflavin-3′-O-gallate


SMILES C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C4=C3C=C(C=C(C4=O)O)[C@@H]5[C@@H](CC6=C(C=C(C=C6O5)O)O)OC(=O)C7=CC(=C(C(=C7)O)O)O)O)O)O
InChIKey KMJPKUVSXFVQGZ-WQLSNUALSA-N

Chemical properties

Hydrogen bond acceptors 16
Hydrogen bond donors 11
Rotatable bonds 4
Molecular weight (Da) 716.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections


Bioactivities