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CHEBI:230411 - (2S)-1-[(2S)-3-(4H-Imidazol-4-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Default Structure
ChEBI IDCHEBI:230411
ChEBI Name(2S)-1-[(2S)-3-(4H-Imidazol-4-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H21N5O5
Net Charge0
Average Mass363.374
Monoisotopic Mass363.15427
SMILESO=C1CC[C@@H](C(=O)N[C@@H](CC2C=NC=N2)C(=O)N2CCC[C@H]2C(=O)O)N1
InChIInChI=1S/C16H21N5O5/c22-13-4-3-10(19-13)14(23)20-11(6-9-7-17-8-18-9)15(24)21-5-1-2-12(21)16(25)26/h7-12H,1-6H2,(H,19,22)(H,20,23)(H,25,26)/t9?,10-,11-,12-/m0/s1
InChIKeyADDJKOLVQCQUMT-LLTYBXMGSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
(2S)-1-[(2S)-3-(4H-Imidazol-4-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carboxylic acid (CHEBI:230411) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(2S)-1-[(2S)-3-(4H-imidazol-4-yl)-2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
Manual XrefsDatabases
108868ChemSpider