Ophidine; (S)-form 

AlkaPlorer ID: AK308680

Synonym: L-form 

IUPAC Name: 2-(3-aminopropanoylamino)-3-(1-methylimidazol-4-yl)propanoic acid

Structure

SMILES: CN1C=NC(CC(NC(=O)CCN)C(=O)O)=C1

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InChI: InChI=1S/C10H16N4O3/c1-14-5-7(12-6-14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)

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InChIKey: SLRNWACWRVGMKD-UHFFFAOYSA-N

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Reference

PubChem CID: 3634183

COCONUT: CNP0225982.1

Properties Information

Molecule Weight: 240.26299999999995

TPSA: 110.24

MolLogP: -1.119199999999998

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information