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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013502

4-[3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(2-methyl-4-oxopyran-3-yl)oxyoxan-3-yl]oxy-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

Formula: C28H30O13  |  Mol. Weight: 574.50 g/mol

IUPAC: 4-[3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(2-methyl-4-oxopyran-3-yl)oxyoxan-3-yl]oxy-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one

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Overview

Molecular Formula C28H30O13
Molecular Weight 574.50 g/mol
Canonical SMILES CC1=C(C(=O)C=CO1)OC2C(C(C(C(O2)CO)O)O)OC(C)(C)C(COC3=C4C=CC(=O)OC4=CC5=C3C=CO5)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy