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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012956

glycitein 7-O-beta-D-(2'',4'',6''-O-triacetyl)glucopyranoside

Formula: C28H28O13  |  Mol. Weight: 572.50 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,5-diacetyloxy-4-hydroxy-6-[3-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate

Overview

Molecular Formula C28H28O13
Molecular Weight 572.50 g/mol
Canonical SMILES CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C3C(=C2)OC=C(C3=O)C4=CC=C(C=C4)O)OC)OC(=O)C)O)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy