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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017783

[(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-[2-(5-hydroxy-7,8-dimethoxy-4-oxochromen-2-yl)phenoxy]-2-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate

Formula: C32H30O12  |  Mol. Weight: 606.60 g/mol

IUPAC: [(2R,3S,4R,5R,6S)-4,5-dihydroxy-6-[2-(5-hydroxy-7,8-dimethoxy-4-oxochromen-2-yl)phenoxy]-2-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate

Overview

Molecular Formula C32H30O12
Molecular Weight 606.60 g/mol
Canonical SMILES COC1=C(C2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=CC=C3OC4C(C(C(C(O4)CO)OC(=O)C=CC5=CC=CC=C5)O)O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy