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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP072055

Nigracin

Formula: C20H22O9  |  Mol. Weight: 406.40 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-hydroxy-2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate

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Overview

Molecular Formula C20H22O9
Molecular Weight 406.40 g/mol
Canonical SMILES C1=CC=C(C=C1)C(=O)OCC2C(C(C(C(O2)OC3=C(C=C(C=C3)O)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Disease Associations