EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:94997 - (2S)-2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]amino]-5-[(1-oxo-2-phosphonoethyl)amino]pentanoic acid

ChEBI IDCHEBI:94997
ChEBI Name(2S)-2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]amino]-5-[(1-oxo-2-phosphonoethyl)amino]pentanoic acid
Stars
DownloadsMolfile
FormulaC11H21N4O8P
Net Charge0
Average Mass368.283
Monoisotopic Mass368.10970
SMILESNCC(=O)NCC(=O)N[C@@H](CCCNC(=O)CP(=O)(O)O)C(=O)O
InChIInChI=1S/C11H21N4O8P/c12-4-8(16)14-5-9(17)15-7(11(19)20)2-1-3-13-10(18)6-24(21,22)23/h7H,1-6,12H2,(H,13,18)(H,14,16)(H,15,17)(H,19,20)(H2,21,22,23)/t7-/m0/s1
InChIKeyAVSPMOKNUVRQBF-ZETCQYMHSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(2S)-2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]amino]-5-[(1-oxo-2-phosphonoethyl)amino]pentanoic acid (CHEBI:94997) is a peptide (CHEBI:16670)
Manual XrefsDatabases
LSM-6223LINCS