ST51037508

2D Structure
CID 43835041
IUPAC Name (3S)-3-amino-4-oxo-4-[[(2S)-1-oxo-3-phenylpropan-2-yl]amino]butanoic acid;hydrate
InChI InChI=1S/C13H16N2O4.H2O/c14-11(7-12(17)18)13(19)15-10(8-16)6-9-4-2-1-3-5-9;/h1-5,8,10-11H,6-7,14H2,(H,15,19)(H,17,18);1H2/t10-,11-;/m0./s1
InChI Key CRIKKZILWBXNFP-ACMTZBLWSA-N
Canonical SMILES None
Isomeric SMILES None
Molecular Formula C13H18N2O5
Molecular Weight 282.29
synonyms ['AKOS024386367', 'ST51037508', '(3S)-3-{N-[(1S)-2-oxo-1-benzylethyl]carbamoyl}-3-aminopropanoic acid, hydrate']

From Pubchem