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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005985

(3E)-6-hydroxy-3-[(4-hydroxyphenyl)-methoxymethylidene]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1-benzofuran-2-one

Formula: C22H22O10  |  Mol. Weight: 446.40 g/mol

IUPAC: (3E)-6-hydroxy-3-[(4-hydroxyphenyl)-methoxymethylidene]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1-benzofuran-2-one

Overview

Molecular Formula C22H22O10
Molecular Weight 446.40 g/mol
Canonical SMILES COC(=C1C2=C(C(=C(C=C2)O)C3C(C(C(C(O3)CO)O)O)O)OC1=O)C4=CC=C(C=C4)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy