HFA

ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID

Created: 1999-07-08
Last modified:  2024-09-27

Find related ligands:

Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count1
Bond Count22
Aromatic Bond Count6
2D diagram of HFA

Chemical Component Summary

NameALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID
Systematic Name (OpenEye OEToolkits)(2S)-2-hydroxy-3-phenyl-propanoic acid
FormulaC9 H10 O3
Molecular Weight166.174
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)C(O)Cc1ccccc1
SMILESCACTVS3.341O[CH](Cc1ccccc1)C(O)=O
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)CC(C(=O)O)O
Canonical SMILESCACTVS3.341 O[C@@H](Cc1ccccc1)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 c1ccc(cc1)C[C@@H](C(=O)O)O
InChIInChI1.03 InChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m0/s1
InChIKeyInChI1.03 VOXXWSYKYCBWHO-QMMMGPOBSA-N

Drug Info: DrugBank

DrugBank IDDB02494 
Name(S)-3-phenyllactic acid
Groups experimental
Synonyms
  • L-(−)-3-phenyllactic acid
  • (S)-3-phenyllactic acid
  • L-3-phenyllactic acid
  • alpha-hydroxy-beta-phenyl-propionic acid
  • L-β-phenyllactic acid
CAS number20312-36-1

Drug Targets

NameTarget SequencePharmacological ActionActions
L-phenylalanine dehydrogenaseMSIDSALNWDGEMTVTRFDRETGAHFVIRLDSTQLGPAAGGTRAAQYSQL...unknown
60S ribosomal protein L10-likeMGRRPARCYRYCKNKPYPKSRFCRGVPDAKIRIFDLGRKKAKVDEFPLGG...unknown
60S ribosomal protein L13aMAEVQVLVLDGRGHLLGRLAAIVAKQVLLGRKVVVVRCEGINISGNFYRN...unknown
60S ribosomal protein L23MSKRGRGGSSGAKFRISLGLPVGAVINCADNTGAKNLYIISVKGIKGRLN...unknown
60S ribosomal protein L15MGAYKYIQELWRKKQSDVMRFLLRVRCWQYRQLSALHRAPRPTRPDKARR...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 444718
ChEBI CHEBI:43065
CCDC/CSD PLACTA01, PLACTA02, AVIMEY, AVIMEY01, HUDYEN, HUDYIR, PLACTA, VOPFAJ, OYUXUE
COD 4500717, 4500718