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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005029

7-[(3,4-Di-O-acetyl-I(2)-D-glucopyranosyl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

Formula: C25H24O12  |  Mol. Weight: 516.40 g/mol

IUPAC: [(2R,3R,4R,5R,6S)-4-acetyloxy-5-hydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-2-(hydroxymethyl)oxan-3-yl] acetate

Overview

Molecular Formula C25H24O12
Molecular Weight 516.40 g/mol
Canonical SMILES CC(=O)OC1C(OC(C(C1OC(=O)C)O)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=C(C=C4)O)O)CO

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy