Pencolide; (Z)-form 

AlkaPlorer ID: AK028573

Synonym: None

IUPAC Name: 2-(3-methyl-2,5-dioxopyrrol-1-yl)but-2-enoic acid

Structure

SMILES: CC=C(C(=O)O)N1C(=O)C=C(C)C1=O

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InChI: InChI=1S/C9H9NO4/c1-3-6(9(13)14)10-7(11)4-5(2)8(10)12/h3-4H,1-2H3,(H,13,14)

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InChIKey: NFDKQFGUQFNACT-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 195.174

TPSA: 74.68

MolLogP: 0.2899

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information