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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018505

I(2)-D-Glucopyranosiduronic acid, (2S)-3,4-dihydro-5-hydroxy-8-methoxy-2-(3-methoxyphenyl)-4-oxo-2H-1-benzopyran-7-yl, methyl ester

Formula: C24H26O12  |  Mol. Weight: 506.50 g/mol

IUPAC: methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2S)-5-hydroxy-8-methoxy-2-(3-methoxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl]oxy]oxane-2-carboxylate

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Overview

Molecular Formula C24H26O12
Molecular Weight 506.50 g/mol
Canonical SMILES COC1=CC=CC(=C1)C2CC(=O)C3=C(O2)C(=C(C=C3O)OC4C(C(C(C(O4)C(=O)OC)O)O)O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy