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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038544

[2-[5,7-dihydroxy-4-oxo-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-yl]-4,5-dihydroxyphenyl] 3,4,5-trihydroxybenzoate

Formula: C28H24O17  |  Mol. Weight: 632.50 g/mol

IUPAC: [2-[5,7-dihydroxy-4-oxo-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-yl]-4,5-dihydroxyphenyl] 3,4,5-trihydroxybenzoate

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Overview

Molecular Formula C28H24O17
Molecular Weight 632.50 g/mol
Canonical SMILES C1=C(C=C(C(=C1O)O)O)C(=O)OC2=CC(=C(C=C2C3=C(C(=O)C4=C(C=C(C=C4O3)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