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28047-15-6,MFCD01725188
Catalog No.:AA00BEUB

28047-15-6 | Phenylac-Gln-OH

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1g
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$31.00   $22.00
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5g
96%
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$52.00   $36.00
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25g
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$193.00   $135.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BEUB
Chemical Name:
Phenylac-Gln-OH
CAS Number:
28047-15-6
Molecular Formula:
C13H16N2O4
Molecular Weight:
264.2771
MDL Number:
MFCD01725188
SMILES:
O=C(Cc1ccccc1)N[C@H](C(=O)O)CCC(=O)N
Properties
Properties
 
BP:
655.5 °C at 760 mmHg  
Form:
Solid  
MP:
85-87?C  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
338  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
7  

Upstream Synthesis Route

[1]TetrahedronAsymmetry,2006,vol.17,#2,p.245-251

[1]Hoppe-Seyler'sZeitschriftfuerPhysiologischeChemie,1915,vol.94,p.5

Downstream Synthesis Route

[1]Hoppe-Seyler'sZeitschriftfurPhysiologischeChemie,1915,vol.94,p.5

[1]TetrahedronAsymmetry,2006,vol.17,p.245-251

[2]JournalofPharmaceuticalSciences,1996,vol.85,p.1049-1052

[1]ChemischeBerichte,1914,vol.47,p.2632    Hoppe-Seyler'sZeitschriftfuerPhysiologischeChemie,1915,vol.94,p.5

Literature

Title: Insights into myalgic encephalomyelitis/chronic fatigue syndrome phenotypes through comprehensive metabolomics.

Journal: Scientific reports 20180101

Title: Urinary phenylacetylglutamine as dosing biomarker for patients with urea cycle disorders.

Journal: Molecular genetics and metabolism 20121101

Title: Ornithine phenylacetate prevents disturbances of motor-evoked potentials induced by intestinal blood in rats with portacaval anastomosis.

Journal: Journal of hepatology 20120101

Title: Structured approach to treat patients with acute liver failure: A hepatic emergency.

Journal: Indian journal of critical care medicine : peer-reviewed, official publication of Indian Society of Critical Care Medicine 20120101

Title: Effect of dietary nitrogen content on the urine metabolite profile of dairy cows assessed by nuclear magnetic resonance (NMR)-based metabolomics.

Journal: Journal of agricultural and food chemistry 20111214

Title: Identification of metabolites in the normal ovary and their transformation in primary and metastatic ovarian cancer.

Journal: PloS one 20110101

Title: Management of hepatic encephalopathy.

Journal: International journal of hepatology 20110101

Title: Metabolome-wide association study identifies multiple biomarkers that discriminate north and south Chinese populations at differing risks of cardiovascular disease: INTERMAP study.

Journal: Journal of proteome research 20101203

Title: An unfolded protein response is the initial cellular response to the expression of mutant matrilin-3 in a mouse model of multiple epiphyseal dysplasia.

Journal: Cell stress & chaperones 20101101

Title: Phase 2 comparison of a novel ammonia scavenging agent with sodium phenylbutyrate in patients with urea cycle disorders: safety, pharmacokinetics and ammonia control.

Journal: Molecular genetics and metabolism 20100701

Title: Pharmacology and safety of glycerol phenylbutyrate in healthy adults and adults with cirrhosis.

Journal: Hepatology (Baltimore, Md.) 20100601

Title: From interstitial cystitis to chronic pelvic pain.

Journal: Journal of medicine and life 20100515

Title: Contribution of proteolytic and metabolic sources to hepatic glutamine by (2)H NMR analysis of urinary phenylacetylglutamine (2)H-enrichment from (2)H(2)O.

Journal: Metabolic engineering 20100101

Title: New insights in nutritional management and amino acid supplementation in urea cycle disorders.

Journal: Molecular genetics and metabolism 20100101

Title: A metabonomic approach identifies human urinary phenylacetylglutamine as a novel marker of interstitial cystitis.

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20091115

Title: L-ornithine and phenylacetate synergistically produce sustained reduction in ammonia and brain water in cirrhotic rats.

Journal: Hepatology (Baltimore, Md.) 20090701

Title: L-ornithine phenylacetate attenuates increased arterial and extracellular brain ammonia and prevents intracranial hypertension in pigs with acute liver failure.

Journal: Hepatology (Baltimore, Md.) 20090701

Title: Acute fatal presentation of ornithine transcarbamylase deficiency in a previously healthy male.

Journal: Hepatology international 20080901

Title: Epigenetic treatment of myelodysplastic syndromes and acute myeloid leukemias.

Journal: Current medicinal chemistry 20080601

Title: Phase I dose escalation clinical trial of phenylbutyrate sodium administered twice daily to patients with advanced solid tumors.

Journal: Investigational new drugs 20070401

Title: Arginase induction by sodium phenylbutyrate in mouse tissues and human cell lines.

Journal: Molecular genetics and metabolism 20070101

Title: L-Ornithine phenylacetate (OP): a novel treatment for hyperammonemia and hepatic encephalopathy.

Journal: Medical hypotheses 20070101

Title: Does acute glutamine depletion enhance the response of glutamine synthesis to fasting in muscle in adult and old rats?

Journal: Clinical nutrition (Edinburgh, Scotland) 20050601

Title: Aging: gene silencing or gene activation?

Journal: Medical hypotheses 20050101

Title: Pharmacokinetics of sodium phenylacetate and sodium benzoate following intravenous administration as both a bolus and continuous infusion to healthy adult volunteers.

Journal: Molecular genetics and metabolism 20040401

Title: Pharmacokinetics of phenylacetate administered as a 30-min infusion in children with refractory cancer.

Journal: Cancer chemotherapy and pharmacology 20031101

Title: A study of a different dose-intense infusion schedule of phenylacetate in patients with recurrent primary brain tumors consortium report.

Journal: Investigational new drugs 20031101

Title: Low water-soluble uremic toxins.

Journal: Advances in renal replacement therapy 20031001

Title: Integration of [U-13C]glucose and 2H2O for quantification of hepatic glucose production and gluconeogenesis.

Journal: NMR in biomedicine 20030601

Title: The preventive effect of antineoplaston AS2-1 on HCC recurrence.

Journal: Oncology reports 20030101

Title: Glutamine transport in isolated epithelial intestinal cells. Identification of a Na+-dependent transport mechanism, highly specific for glutamine.

Journal: Pflugers Archiv : European journal of physiology 20021201

Title: Identification of phenylbutyrylglutamine, a new metabolite of phenylbutyrate metabolism in humans.

Journal: Journal of mass spectrometry : JMS 20020601

Title: An integrated (2)H and (13)C NMR study of gluconeogenesis and TCA cycle flux in humans.

Journal: American journal of physiology. Endocrinology and metabolism 20011001

Title: A Phase I clinical and pharmacological evaluation of sodium phenylbutyrate on an 120-h infusion schedule.

Journal: Clinical cancer research : an official journal of the American Association for Cancer Research 20011001

Title: A phase I dose escalation and bioavailability study of oral sodium phenylbutyrate in patients with refractory solid tumor malignancies.

Journal: Clinical cancer research : an official journal of the American Association for Cancer Research 20010801

Title: Poesen R, et al. Microbiota-Derived Phenylacetylglutamine Associates with Overall Mortality and Cardiovascular Disease in Patients with CKD. J Am Soc Nephrol. 2016 Nov;27(11):3479-3487.

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Tags:28047-15-6 Molecular Formula|28047-15-6 MDL|28047-15-6 SMILES|28047-15-6 Phenylac-Gln-OH