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Details

Stereochemistry ACHIRAL
Molecular Formula C9H7O3.Na
Molecular Weight 186.1398
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM PHENYLPYRUVATE

SMILES

[Na+].[O-]C(=O)C(=O)CC1=CC=CC=C1

InChI

InChIKey=MQGYVGKMCRDEAF-UHFFFAOYSA-M
InChI=1S/C9H8O3.Na/c10-8(9(11)12)6-7-4-2-1-3-5-7;/h1-5H,6H2,(H,11,12);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C9H7O3
Molecular Weight 163.1501
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Accumulation of a tetrahydroisoquinoline in phenylketonuria.
1979 Jan 19
Molecular analysis of the role of two aromatic aminotransferases and a broad-specificity aspartate aminotransferase in the aromatic amino acid metabolism of Pyrococcus furiosus.
2002 Sep
Estrogen-inducible uterine flavonoid binding sites: is it time to reconsider?
2004 Apr
Identification of proteins in laser-microdissected small cell numbers by SELDI-TOF and Tandem MS.
2004 Dec 3
[Compared D-amino acid oxidase expression in different Pichia pastoris host strains].
2004 Jul
A molecularly imprinted polymer-based synthetic transaminase.
2004 Jul 14
Enantioselective synthesis of non-natural amino acids using phenylalanine dehydrogenases modified by site-directed mutagenesis.
2004 Sep 21
Ketone bodies affect the enzymatic activity of macrophage migration inhibitory factor.
2005 Aug 5
Impaired glutamatergic synaptic transmission in the PKU brain.
2005 Dec
Iron Coordination Chemistry of Phenylpyruvate: An Unexpected kappa3-bridging mode that leads to oxidative cleavage of the C2-C3 bond.
2005 Feb 7
N-methyl-L-amino acid dehydrogenase from Pseudomonas putida. A novel member of an unusual NAD(P)-dependent oxidoreductase superfamily.
2005 Mar
Plant-derived anti-inflammatory compounds affect MIF tautomerase activity.
2005 May
Some insights into the stereochemistry of inhibition of macrophage migration inhibitory factor with 2-fluoro-p-hydroxycinnamate and its analogues from molecular dynamics simulations.
2005 Nov 17
Mechanism of the insulin-releasing action of alpha-ketoisocaproate and related alpha-keto acid anions.
2005 Oct
Effect of L-serine on the biosynthesis of aromatic amino acids in Escherichia coli.
2006 Aug
Response variability in Attention-Deficit/Hyperactivity Disorder: a neuronal and glial energetics hypothesis.
2006 Aug 23
Chemical conversion of alpha-amino acids into alpha-keto acids by 4,5-epoxy-2-decenal.
2006 Aug 9
Xenofuranones A and B: phenylpyruvate dimers from Xenorhabdus szentirmaii.
2006 Dec
First experimental demonstration of the multipotential carcinogenic effects of aspartame administered in the feed to Sprague-Dawley rats.
2006 Mar
G-protein-coupled receptor 1, G-protein Galpha-subunit 1, and prephenate dehydratase 1 are required for blue light-induced production of phenylalanine in etiolated Arabidopsis.
2006 Mar
Biosynthesis of plant-specific stilbene polyketides in metabolically engineered Escherichia coli.
2006 Mar 21
Metabolic engineering of the E. coli L-phenylalanine pathway for the production of D-phenylglycine (D-Phg).
2006 May
Catalytic, noncatalytic, and inhibitory phenomena: kinetic analysis of (4-hydroxyphenyl)pyruvate dioxygenase from Arabidopsis thaliana.
2006 May 16
A monofunctional and thermostable prephenate dehydratase from the archaeon Methanocaldococcus jannaschii.
2006 Nov 28
Iron-catalyzed C2-C3 bond cleavage of phenylpyruvate with O2: insight into aliphatic C-C bond-cleaving dioxygenases.
2007
Biotransformation of phenylpyruvic acid to phenyllactic acid by growing and resting cells of a Lactobacillus sp.
2007 Apr
Nucleophile selectivity of chorismate-utilizing enzymes.
2007 Apr 16
Phenylpyruvate tautomerase activity of trans-3-chloroacrylic acid dehalogenase: evidence for an enol intermediate in the dehalogenase reaction?
2007 Aug 21
Near-ultraviolet photolysis of beta-phenylpyruvic acid generates free radicals and results in DNA damage.
2007 Dec 14
MIF tautomerase inhibitor potency of alpha,beta-unsaturated cyclic ketones.
2007 Dec 15
Biosynthesis of (R)-beta-tyrosine and its incorporation into the highly cytotoxic chondramides produced by Chondromyces crocatus.
2007 Jul 27
Simultaneous determination of ketoacids and dicarbonyl compounds, key Maillard intermediates on the generation of aged wine aroma.
2007 Jun
Characterization and application of D-amino acid oxidase and catalase within permeabilized Pichia pastoris cells in bioconversions.
2007 Mar
The crystal structure of phenylpyruvate decarboxylase from Azospirillum brasilense at 1.5 A resolution. Implications for its catalytic and regulatory mechanism.
2007 May
Flavonoid and hydroxycinnamate profiles of english apple ciders.
2007 Oct 17
Phenylalanine biosynthesis in Arabidopsis thaliana. Identification and characterization of arogenate dehydratases.
2007 Oct 19
Life-span exposure to low doses of aspartame beginning during prenatal life increases cancer effects in rats.
2007 Sep
Identification of a novel glyoxylate reductase supports phylogeny-based enzymatic substrate specificity prediction.
2007 Sep
Metabolic transcription analysis of engineered Escherichia coli strains that overproduce L-phenylalanine.
2007 Sep 19
Organic acid concentrations in amniotic fluid found in normal and Down syndrome pregnancies.
2008
Semidominant mutations in reduced epidermal fluorescence 4 reduce phenylpropanoid content in Arabidopsis.
2008 Apr
Structures of open (R) and close (T) states of prephenate dehydratase (PDT)--implication of allosteric regulation by L-phenylalanine.
2008 Apr
Purification and partial characterization of Lactobacillus species SK007 lactate dehydrogenase (LDH) catalyzing phenylpyruvic acid (PPA) conversion into phenyllactic acid (PLA).
2008 Apr 9
Coutilization of glucose and glycerol enhances the production of aromatic compounds in an Escherichia coli strain lacking the phosphoenolpyruvate: carbohydrate phosphotransferase system.
2008 Jan 22
Erwinia amylovora modifies phenolic profiles of susceptible and resistant apple through its type III secretion system.
2008 Mar
Comparative analysis of Acinetobacters: three genomes for three lifestyles.
2008 Mar 19
Mechanism of benzaldehyde lyase studied via thiamin diphosphate-bound intermediates and kinetic isotope effects.
2008 Mar 25
Crystal structure of VioE, a key player in the construction of the molecular skeleton of violacein.
2008 Mar 7
Mutation of a rice gene encoding a phenylalanine biosynthetic enzyme results in accumulation of phenylalanine and tryptophan.
2008 May
Structural studies of prephenate dehydratase from Mycobacterium tuberculosis H37Rv by SAXS, ultracentrifugation, and computational analysis.
2008 Sep
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 05:26:17 GMT 2023
Edited
by admin
on Sat Dec 16 05:26:17 GMT 2023
Record UNII
7528CW33WW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM PHENYLPYRUVATE
Systematic Name English
PHENYLPYRORACEMIC ACID SODIUM SALT
Common Name English
NSC-1470
Code English
PYRUVIC ACID, PHENYL-, SODIUM SALT
Common Name English
BENZENEPROPANOIC ACID, .ALPHA.-OXO-, SODIUM SALT (1:1)
Systematic Name English
PHENYLPYRUVIC ACID SODIUM SALT
Common Name English
SODIUM 2-OXO-3-PHENYLPROPANOATE
Systematic Name English
.BETA.-PHENYLPYRUVIC ACID SODIUM SALT
Common Name English
SODIUM 3-PHENYL-2-OXOPROPIONATE
Systematic Name English
SODIUM .BETA.-PHENYLPYRUVATE
Systematic Name English
BENZENEPROPANOIC ACID, .ALPHA.-OXO-, SODIUM SALT
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
204-053-2
Created by admin on Sat Dec 16 05:26:17 GMT 2023 , Edited by admin on Sat Dec 16 05:26:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID001019012
Created by admin on Sat Dec 16 05:26:17 GMT 2023 , Edited by admin on Sat Dec 16 05:26:17 GMT 2023
PRIMARY
CAS
114-76-1
Created by admin on Sat Dec 16 05:26:17 GMT 2023 , Edited by admin on Sat Dec 16 05:26:17 GMT 2023
PRIMARY
NSC
1470
Created by admin on Sat Dec 16 05:26:17 GMT 2023 , Edited by admin on Sat Dec 16 05:26:17 GMT 2023
PRIMARY
PUBCHEM
23667645
Created by admin on Sat Dec 16 05:26:17 GMT 2023 , Edited by admin on Sat Dec 16 05:26:17 GMT 2023
PRIMARY
FDA UNII
7528CW33WW
Created by admin on Sat Dec 16 05:26:17 GMT 2023 , Edited by admin on Sat Dec 16 05:26:17 GMT 2023
PRIMARY