Chemical Component Summary

Name3-PHENYLPYRUVIC ACID
Identifiers2-oxo-3-phenyl-propanoic acid
FormulaC9 H8 O3
Molecular Weight164.158
TypeNON-POLYMER
Isomeric SMILESc1ccc(cc1)CC(=O)C(=O)O
InChIInChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)
InChIKeyBTNMPGBKDVTSJY-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count20
Chiral Atom Count0
Bond Count20
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB03884 
NamePhenylpyruvic acid
Groups experimental
Synonyms
  • Calcium phenylpyruvate
  • 3-phenyl-2-oxopropanoic acid
  • 2-oxo-3-phenylpropanic acid
  • Phenylpyruvic acid
  • Phenylbrenztraubensäure
Categories
  • Acids, Carbocyclic
  • Keto Acids
  • Pyruvates
CAS number156-06-9

Drug Targets

NameTarget SequencePharmacological ActionActions
L-phenylalanine dehydrogenaseMSIDSALNWDGEMTVTRFDRETGAHFVIRLDSTQLGPAAGGTRAAQYSQL...unknown
Hydroxyacid oxidase 1MLPRLICINDYEQHAKSVLPKSIYDYYRSGANDEETLADNIAAFSRWKLY...unknown
Indole-3-pyruvate decarboxylaseMKLAEALLRALKDRGAQAMFGIPGDFALPFFKVAEETQILPLHTLSHEPA...unknown
Putative uncharacterized proteinMENREPPLLPARWSSAYVSYWSPMLPDDQLTSGYCWFDYERDICRIDGLF...unknown
Bacilysin biosynthesis protein BacBMKTKEDMQELYFPTPKLIEWENGVRQYSTVRGDTEVLMSYVPPHTNVEPH...unknown
View More
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 997
ChEMBL CHEMBL1162488
ChEBI CHEBI:30851