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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007980

[(2R,3S,4S,5R,6R)-3,4,6-trihydroxy-5-(4-hydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

Formula: C20H20O12  |  Mol. Weight: 452.40 g/mol

IUPAC: [(2R,3S,4S,5R,6R)-3,4,6-trihydroxy-5-(4-hydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

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Overview

Molecular Formula C20H20O12
Molecular Weight 452.40 g/mol
Canonical SMILES C1=CC(=CC=C1C(=O)OC2C(C(C(OC2O)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy