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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016812

(2S)-3-(3,4-dihydroxyphenyl)-2-[[2-[(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetyl]amino]propanoic acid

Formula: C21H27NO6  |  Mol. Weight: 389.40 g/mol

IUPAC: (2S)-3-(3,4-dihydroxyphenyl)-2-[[2-[(1R,2R)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetyl]amino]propanoic acid

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Overview

Molecular Formula C21H27NO6
Molecular Weight 389.40 g/mol
Canonical SMILES CCC=CCC1C(CCC1=O)CC(=O)NC(CC2=CC(=C(C=C2)O)O)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy