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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP029790

5-Cyclohexene-1,2,3,4-tetrol, 2-[(benzoyloxy)methyl]-, 4-benzoate, (1R,2S,3R,4S)-

Formula: C21H20O7  |  Mol. Weight: 384.40 g/mol

IUPAC: [(1S,2R,5S,6R)-5-benzoyloxy-1,2,6-trihydroxycyclohex-3-en-1-yl]methyl benzoate

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Overview

Molecular Formula C21H20O7
Molecular Weight 384.40 g/mol
Canonical SMILES C1=CC=C(C=C1)C(=O)OCC2(C(C=CC(C2O)OC(=O)C3=CC=CC=C3)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy