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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP020173

[(2R,3S,4R,5R,6S)-6-(4-formylphenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

Formula: C22H22O10  |  Mol. Weight: 446.40 g/mol

IUPAC: [(2R,3S,4R,5R,6S)-6-(4-formylphenoxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

Overview

Molecular Formula C22H22O10
Molecular Weight 446.40 g/mol
Canonical SMILES C1=CC(=CC=C1C=O)OC2C(C(C(C(O2)CO)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy