Homothallin

AlkaPlorer ID: AK300615

Synonym: 3-(3-Isocyanocyclopenten-1-ylidene)propanoic acid

IUPAC Name: 3-(3-isocyanocyclopent-2-en-1-ylidene)propanoic acid

Structure

SMILES: [C-]#[N+]C1=CC(=CCC(=O)O)CC1

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InChI: InChI=1S/C9H9NO2/c1-10-8-4-2-7(6-8)3-5-9(11)12/h3,6H,2,4-5H2,(H,11,12)

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InChIKey: SBHNPHNIVBXIMQ-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 163.17599999999996

TPSA: 41.66

MolLogP: 1.98449

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information