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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003790

[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2-[(2S,3R,4S,5R,6R)-3,4-diacetyloxy-6-(acetyloxymethyl)-5-hydroxyoxan-2-yl]oxy-6-hydroxybenzoate

Formula: C32H38O18  |  Mol. Weight: 710.60 g/mol

IUPAC: [2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2-[(2S,3R,4S,5R,6R)-3,4-diacetyloxy-6-(acetyloxymethyl)-5-hydroxyoxan-2-yl]oxy-6-hydroxybenzoate

Overview

Molecular Formula C32H38O18
Molecular Weight 710.60 g/mol
Canonical SMILES CC(=O)OCC1C(C(C(C(O1)OC2=CC=CC(=C2C(=O)OCC3=CC=CC=C3OC4C(C(C(C(O4)CO)O)O)O)O)OC(=O)C)OC(=O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy