(2S)-2-(2-ammonioacetamido)propanoate

AlkaPlorer ID: AK550693

Synonym: None

IUPAC Name: 2-[(2-aminoacetyl)amino]propanoic acid

Structure

SMILES: CC(N=C(O)CN)C(=O)O

copy

InChI: InChI=1S/C5H10N2O3/c1-3(5(9)10)7-4(8)2-6/h3H,2,6H2,1H3,(H,7,8)(H,9,10)

copy

InChIKey: VPZXBVLAVMBEQI-UHFFFAOYSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Blighia sapida Blighia Sapindaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 146.14600000000002

TPSA: 95.91

MolLogP: -0.6252999999999991

Number of H-Donors: 3

Number of H-Acceptors: 3

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Oligopeptide transporter small intestine isoform Ki 380000.0 nM 10.1021/jm030976x
Saccharomyces cerevisiae General amino-acid permease GAP1 Activity nan None 10.1038/nchembio.132
Saccharomyces cerevisiae General amino-acid permease GAP1 Inhibition 15.0 % 10.1038/nchembio.132
None No relevant target LogP 3.56 None 10.1021/jm00393a031
None Unchecked Log 1/T nan None 10.1021/jm00393a031

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT006557 CC(N=C(O)CN)C(=O)O.NCC(=O)O>>CC(N=C(O)CN=C(O)CN)C(=O)O MNXR151485
AKRT013413 C[C@H](N)C(=O)NCC(=O)N[C@@H](C)C(=O)O>>CC(N=C(O)CN)C(=O)O MNXR129964