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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009680

1-[2,4-bis[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]phenyl]-3-(4-methoxyphenyl)propan-1-one

Formula: C28H36O14  |  Mol. Weight: 596.60 g/mol

IUPAC: 1-[2,4-bis[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]phenyl]-3-(4-methoxyphenyl)propan-1-one

Overview

Molecular Formula C28H36O14
Molecular Weight 596.60 g/mol
Canonical SMILES COC1=CC=C(C=C1)CCC(=O)C2=C(C=C(C=C2)OC3C(C(C(C(O3)CO)O)O)O)OC4C(C(C(C(O4)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy