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CHEBI:231247 - Histidine glutamate

ChEBI IDCHEBI:231247
ChEBI NameHistidine glutamate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16N4O6
Net Charge0
Average Mass300.271
Monoisotopic Mass300.10698
SMILESNC(Cc1cncn1)C(=O)OOC(=O)[C@H](N)CCC(=O)O
InChIInChI=1S/C11H16N4O6/c12-7(1-2-9(16)17)10(18)20-21-11(19)8(13)3-6-4-14-5-15-6/h4-5,7-8H,1-3,12-13H2,(H,14,15)(H,16,17)/t7-,8?/m1/s1
InChIKeyZLVGZHNHLKDPNE-GVHYBUMESA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
Histidine glutamate (CHEBI:231247) is a histidine derivative (CHEBI:24599)
IUPAC Name 
(4R)-4-amino-5-[2-amino-3-(1H-imidazol-5-yl)propanoyl]peroxy-5-oxopentanoic acid
Manual XrefsDatabases
67159107ChemSpider