Record Information
Version1.0
Creation date2011-09-21 00:13:01 UTC
Update date2015-07-21 06:57:10 UTC
Primary IDFDB022377
Secondary Accession NumbersNot Available
Chemical Information
FooDB NamePhosphohydroxypyruvic acid
DescriptionPhosphohydroxypyruvic acid is a prduct of both enzyme phosphoglycerate dehydrogenase [EC 1.1.1.95] and phosphoserine transaminase [EC 2.6.1.52] in glycine, serine and threonine metabolism pathway (KEGG). [HMDB]
CAS Number3913-50-6
Structure
Thumb
Synonyms
SynonymSource
2-oxo-3-(Onooxy)-propanoateHMDB
2-oxo-3-(Onooxy)-propanoic acidHMDB
2-oxo-3-(phosphonooxy)-Propanoatehmdb
2-oxo-3-(phosphonooxy)-Propanoic acidhmdb
3-OhydroxypyruvateGenerator
3-Ohydroxypyruvic acidChEBI
3-OnatooxypyruvateHMDB
3-OnooxypyruvateGenerator
3-Onooxypyruvic acidChEBI
3-Phosphohydroxypyruvatehmdb
3-Phosphohydroxypyruvic acidhmdb
3-Phosphonooxypyruvatehmdb
3-Phosphonooxypyruvic acidhmdb
Hydroxypyruvate ateGenerator
Hydroxypyruvic acid ateChEBI
Hydroxypyruvic acid ic acidGenerator
OhydroxypyruvateGenerator
Ohydroxypyruvic acidChEBI
Phosphohydroxypyruvatehmdb
phosphohydroxypyruvic acidhmdb
Predicted PropertiesNot Available
Chemical FormulaC3H5O7P
IUPAC name
InChI IdentifierInChI=1S/C3H5O7P/c4-2(3(5)6)1-10-11(7,8)9/h1H2,(H,5,6)(H2,7,8,9)
InChI KeyLFLUCDOSQPJJBE-UHFFFAOYSA-N
Isomeric SMILESOC(=O)C(=O)COP(O)(O)=O
Average Molecular Weight184.0414
Monoisotopic Molecular Weight183.977289026
Classification
ClassificationNot classified
Ontology
Disposition

Biological location:

Source:

Physico-Chemical Properties - Experimental
Physico-Chemical Properties - Experimental
PropertyValueReference
Physical stateSolid
Physical DescriptionNot Available
Mass CompositionNot Available
Melting PointNot Available
Boiling PointNot Available
Experimental Water SolubilityNot Available
Experimental logPNot Available
Experimental pKaNot Available
Isoelectric pointNot Available
ChargeNot Available
Optical RotationNot Available
Spectroscopic UV DataNot Available
DensityNot Available
Refractive IndexNot Available
Spectra
Spectra
Spectrum TypeDescriptionSplash Key
Predicted GC-MSPredicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positivesplash10-0002-9300000000-33ff06735f8214248ea3View in MoNA
Predicted GC-MSPredicted GC-MS Spectrum - GC-MS (1 TMS) - 70eV, Positivesplash10-00xr-9510000000-f67b2feb11cbb37fdf47View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-001i-0900000000-4411ba8f6713e6b68f94View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-00s9-0900000000-457227604cff5cdecb73View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-05g0-6900000000-5ced177e050ba3272f0fView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-003r-3900000000-22820af5ec79da81207bView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-004i-9300000000-0127ef53c9426c592779View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-004i-9000000000-4ba77bd112070310c576View in MoNA
ChemSpider ID103
ChEMBL IDNot Available
KEGG Compound IDC03232
Pubchem Compound ID105
Pubchem Substance IDNot Available
ChEBI ID30933
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDHMDB01024
CRC / DFC (Dictionary of Food Compounds) IDNot Available
EAFUS IDNot Available
Dr. Duke IDNot Available
BIGG ID41453
KNApSAcK IDNot Available
HET IDHPV
Food Biomarker OntologyNot Available
VMH IDNot Available
Flavornet IDNot Available
GoodScent IDNot Available
SuperScent IDNot Available
Wikipedia IDPhosphohydroxypyruvic acid
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
FoodReference
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
Enzymes
NameGene NameUniProt ID
Phosphoserine aminotransferasePSAT1Q9Y617
Pathways
NameSMPDB LinkKEGG Link
Glycine and Serine MetabolismSMP00004 map00260
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
FlavoursNot Available
Files
MSDSNot Available
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference