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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP021171

(1S)-1,5-anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-6-yl]-2-O-beta-D-glucopyranosyl-L-arabinitol

Formula: C26H28O15  |  Mol. Weight: 580.50 g/mol

IUPAC: 2-(3,4-dihydroxyphenyl)-6-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxychromen-4-one

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Overview

Molecular Formula C26H28O15
Molecular Weight 580.50 g/mol
Canonical SMILES C1C(C(C(C(O1)C2=C(C3=C(C=C2O)OC(=CC3=O)C4=CC(=C(C=C4)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy