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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP014172

(2R,3R,4S,5S,6R)-2-[(3R,5R)-7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Formula: C26H36O11  |  Mol. Weight: 524.60 g/mol

IUPAC: (2R,3R,4S,5S,6R)-2-[(3R,5R)-7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)heptan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Overview

Molecular Formula C26H36O11
Molecular Weight 524.60 g/mol
Canonical SMILES COC1=C(C=CC(=C1)CCC(CC(CCC2=CC(=C(C=C2)O)O)O)OC3C(C(C(C(O3)CO)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy