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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP075559

Ochratoxin A

Formula: C20H18ClNO6  |  Mol. Weight: 403.80 g/mol

IUPAC: (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid

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Overview

Molecular Formula C20H18ClNO6
Molecular Weight 403.80 g/mol
Canonical SMILES CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC3=CC=CC=C3)C(=O)O)Cl

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Therapeutics & Targets

Disease Associations