2,6-Diamino-4-hexenoic acid; (±)-(E)-form, N2-Ac 

AlkaPlorer ID: AK295134

Synonym: 2-Acetamido-6-amino-4-hexenoic acid, Antibiotic BA 12, BA 12

IUPAC Name: (Z)-2-acetamido-6-aminohex-4-enoic acid

Structure

SMILES: CC(=O)NC(C/C=C\CN)C(=O)O

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InChI: InChI=1S/C8H14N2O3/c1-6(11)10-7(8(12)13)4-2-3-5-9/h2-3,7H,4-5,9H2,1H3,(H,10,11)(H,12,13)/b3-2-

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InChIKey: VOLMYNNEVGLNMS-IHWYPQMZSA-N

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Reference

CAS: 118021-39-9

Source

Properties Information

Molecule Weight: 186.211

TPSA: 92.42

MolLogP: -0.5192999999999992

Number of H-Donors: 3

Number of H-Acceptors: 3

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information