CHEBI:183945 - [(3R)-3-aMino-4-[(3-hexylphenyl)aMino]-4-oxobutyl]-phosphonic acid

ChEBI IDCHEBI:183945
ChEBI Name[(3R)-3-aMino-4-[(3-hexylphenyl)aMino]-4-oxobutyl]-phosphonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H27N2O4P
Net Charge0
Average Mass342.376
Monoisotopic Mass342.17084
SMILESCCCCCCc1cccc(NC(=O)[C@H](N)CCP(=O)(O)O)c1
InChIInChI=1S/C16H27N2O4P/c1-2-3-4-5-7-13-8-6-9-14(12-13)18-16(19)15(17)10-11-23(20,21)22/h6,8-9,12,15H,2-5,7,10-11,17H2,1H3,(H,18,19)(H2,20,21,22)/t15-/m1/s1
InChIKeyFWJRVGZWNDOOFH-OAHLLOKOSA-N
Species of MetaboliteComponentSourceComments
Nippostrongylus brasiliensis (ncbitaxon:27835) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3486)
Mus musculus (ncbitaxon:10090) small intestine (BTO:0000651) MetaboLights (MTBLS3486) Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424]
ChEBI Ontology
Outgoing Relation(s)
[(3R)-3-aMino-4-[(3-hexylphenyl)aMino]-4-oxobutyl]-phosphonic acid (CHEBI:183945) is a amino acid amide (CHEBI:22475)
IUPAC Name 
[(3R)-3-amino-4-(3-hexylanilino)-4-oxobutyl]phosphonic acid
Manual XrefsDatabases
5257126ChemSpider
ML5PDBeChem