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775-01-9,MFCD00004231
Catalog No.:AA001L5K

775-01-9 | Dl-3,4-dihydroxymandelic acid

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50mg
≥95%
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$56.00   $39.00
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100mg
≥95%
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$95.00   $66.00
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250mg
≥95%
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$209.00   $146.00
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500mg
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001L5K
Chemical Name:
Dl-3,4-dihydroxymandelic acid
CAS Number:
775-01-9
Molecular Formula:
C8H8O5
Molecular Weight:
184.1461
MDL Number:
MFCD00004231
SMILES:
OC(=O)C(c1ccc(c(c1)O)O)O
Properties
Properties
 
Form:
Solid  
MP:
>127°C (dec.)  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
193  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-0.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:KONINKLIJKEDSMN.V.-WO2007/9590,2007,A1Locationinpatent:Page/Pagecolumn3

[2]CurrentPatentAssignee:KONINKLIJKEDSMN.V.-EP1982706,2008,A1Locationinpatent:Page/Pagecolumn11-12

[3]CurrentPatentAssignee:KONINKLIJKEDSMN.V.-WO2007/9590,2007,A1Locationinpatent:Page/Pagecolumn3-5

775-01-9    62571-86-2   
C17H21NO8S 

[1]JournalofAgriculturalandFoodChemistry,2009,vol.57,p.1143-1150

[1]Ito,Shosuke;Yamanaka,Yuta;Ojika,Makoto;Wakamatsu,Kazumasa[InternationalJournalofMolecularSciences,2016,vol.17,#2]

Literature

Title: Investigation on the enantioselectivity of the sulfation of the methylenedioxymethamphetamine metabolites 3,4-dihydroxymethamphetamine and 4-hydroxy-3-methoxymethamphetamine using the substrate-depletion approach.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20111101

Title: Sulfation of the 3,4-methylenedioxymethamphetamine (MDMA) metabolites 3,4-dihydroxymethamphetamine (DHMA) and 4-hydroxy-3-methoxymethamphetamine (HMMA) and their capability to inhibit human sulfotransferases.

Journal: Toxicology letters 20110425

Title: Investigation by imaging mass spectrometry of biomarker candidates for aging in the hair cortex.

Journal: PloS one 20110101

Title: A metabonomics study of the hepatotoxicants galactosamine, methylene dianiline and clofibrate in rats.

Journal: Basic & clinical pharmacology & toxicology 20060901

Title: 3,4-Dihydroxymandelic acid, a noradrenalin metabolite with powerful antioxidative potential.

Journal: Journal of agricultural and food chemistry 20021009

Title: Norepinephrine metabolism in neuron: dissociation between 3,4-dihydroxyphenylglycol and 3,4-dihydroxymandelic acid pathways.

Journal: Acta pharmacologica Sinica 20020101

Title: Molecular mechanisms controlling the rate and specificity of catechol O-methylation by human soluble catechol O-methyltransferase.

Journal: Molecular pharmacology 20010201

Title: Molecular cloning and characterization of a new multispecific organic anion transporter from rat brain.

Journal: The Journal of biological chemistry 19990507

Title: Sule N, et al. The Norepinephrine Metabolite 3,4-Dihydroxymandelic Acid Is Produced by the Commensal Microbiota and Promotes Chemotaxis and Virulence Gene Expression in Enterohemorrhagic Escherichia coli. Infect Immun. 2017 Sep 20;85(10).

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SDS
Tags:775-01-9 Molecular Formula|775-01-9 MDL|775-01-9 SMILES|775-01-9 Dl-3,4-dihydroxymandelic acid