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CHEBI:177686 - Iprofenin

ChEBI IDCHEBI:177686
ChEBI NameIprofenin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20N2O5
Net Charge0
Average Mass308.334
Monoisotopic Mass308.13722
SMILESCC(C)c1ccc(NC(=O)CN(CC(=O)O)CC(=O)O)cc1
InChIInChI=1S/C15H20N2O5/c1-10(2)11-3-5-12(6-4-11)16-13(18)7-17(8-14(19)20)9-15(21)22/h3-6,10H,7-9H2,1-2H3,(H,16,18)(H,19,20)(H,21,22)
InChIKeyFPTRWYHXARAFPO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
Iprofenin (CHEBI:177686) is a amino acid amide (CHEBI:22475)
IUPAC Name 
2-[carboxymethyl-[2-oxo-2-(4-propan-2-ylanilino)ethyl]amino]acetic acid
Manual XrefsDatabases
D04607KEGG DRUG
43576ChemSpider
Registry NumbersSources
CAS:66292-53-3ChemIDplus