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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016899

Bilagrewin

Formula: C21H22O8  |  Mol. Weight: 402.40 g/mol

IUPAC: (E)-3-[(2S,3S)-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl]prop-2-enal

Overview

Molecular Formula C21H22O8
Molecular Weight 402.40 g/mol
Canonical SMILES COC1=CC(=CC2=C1OC(C(O2)C3=CC(=C(C(=C3)OC)O)OC)CO)C=CC=O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy