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CHEBI:178064 - Phenylalanine-13C9

Default Structure
ChEBI IDCHEBI:178064
ChEBI NamePhenylalanine-13C9
Stars
Last Modified30 August 2023
SubmitterMetaboLights
DownloadsMolfile
Formula[13C9]H11NO2
Net Charge0
Average Mass174.123
Monoisotopic Mass174.10917
SMILESN[13C@H]([13CH2][13c]1[13cH][13cH][13cH][13cH][13cH]1)[13C](=O)O
InChIInChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1
InChIKeyCOLNVLDHVKWLRT-RIQGLZQJSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2187)
ChEBI Ontology
Outgoing Relation(s)
Phenylalanine-13C9 (CHEBI:178064) is a 13C-modified compound (CHEBI:139357)
Phenylalanine-13C9 (CHEBI:178064) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name 
(2S)-2-amino-3-((1,2,3,4,5,6-13C6)cyclohexatrienyl)(1,2,3-13C3)propanoic acid
Manual XrefsDatabases
48244805ChemSpider