Dermadin

AlkaPlorer ID: AK294889

Synonym: 3-(3-Isocyano-6-oxabicyclo[3.1.0]hex-3-en-1-yl)-2-propenoic acid, Antibiotic U 21963, U 21963

IUPAC Name: 3-(3-isocyano-6-oxabicyclo[3.1.0]hex-3-en-1-yl)prop-2-enoic acid

Structure

SMILES: [C-]#[N+]C1=CC2OC2(C=CC(=O)O)C1

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InChI: InChI=1S/C9H7NO3/c1-10-6-4-7-9(5-6,13-7)3-2-8(11)12/h2-4,7H,5H2,(H,11,12)

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InChIKey: HNYIOENSKUGAAX-UHFFFAOYSA-N

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Reference

PubChem CID: 53887139

CAS: 83374-67-8

Properties Information

Molecule Weight: 177.15899999999996

TPSA: 54.19

MolLogP: 0.97169

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information