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Citric acid-d4

CAT: 0804-HY-N1428S-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N1428S-01Size:5 mg
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Description
Citric acid-d4 is the deuterium labeled Citric acid. Citric acid is a natural preservative and food tartness enhancer. Citric acid induces apoptosis and cell cycle arrest at G2/M phase and S phase in HaCaT cells. Citric acid cause oxidative damage of the liver by means of the decrease of antioxidative enzyme activities. Citric acid is also an acidulant, emulsifier, sequestrant and buffering agent widely used across many industries[1][2][3][4].
CAS Number
147664-83-3
UNSPSC
12352211
Hazard Statement
H302, H315, H319, H335
Target
Apoptosis; Bacterial; Endogenous Metabolite; Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Anti-infection; Apoptosis; Metabolic Enzyme/Protease; Others
Field of Research
Cancer; Infection; Metabolic Disease; Inflammation/Immunology; Cardiovascular Disease
Purity
99.31
Solubility
10 mM in DMSO|DMSO : 100mg/mL (ultrasonic) |H2O : 100mg/mL (ultrasonic)
Smiles
OC(C([2H])([2H])C(C(O)=O)(O)C([2H])([2H])C(O)=O)=O
Molecular Formula
C6H4D4O7
Molecular Weight
196.15
Precautions
H302, H315, H319, H335
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216. |[2]Ying TH, et al. Citric acid induces cell-cycle arrest and apoptosis of human immortalized keratinocyte cell line (HaCaT) via caspase- and mitochondrial-dependent signaling pathways. Anticancer Res. 2013 Oct;33 (10) :4411-20.|[3]Abdel-Salam OM, et al. Citric acid effects on brain and liver oxidative stress in lipopolysaccharide-treated mice. J Med Food. 2014 May;17 (5) :588-98.|[4]Lacour B, et al. Stimulation by citric acid of calcium and phosphorus bioavailability in rats fed a calcium-rich diet. Miner Electrolyte Metab. 1997;23 (2) :79-87.|[5]Nagai R, et al. Citric acid inhibits development of cataracts, proteinuria and ketosis in streptozotocin (type 1) diabetic rats. Biochem Biophys Res Commun. 2010 Feb 26;393 (1) :118-22.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, sealed storage, away from moisture and light)
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

2-Hydroxy(~2~H_4_)propane-1,2,3-tricarboxylic acid

Citric acid-d4 is a deuterated compound that is citric acid in which the four methylene hydrogens are replaced by deuterium. It is a tertiary alcohol, a tricarboxylic acid and a deuterated compound.

CAS Number147664-83-3
PubChem CID16213286
IUPAC Name1,1,3,3-tetradeuterio-2-hydroxypropane-1,2,3-tricarboxylic acid
Molecular FormulaC6H8O7
Molecular Weight196.15
XLogP-1.7
Topological Polar Surface Area132
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count13
Formal Charge0
Complexity227
SMILES
[2H]C([2H])(C(=O)O)C(C(=O)O)(C([2H])([2H])C(=O)O)O
InChI
InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/i1D2,2D2
InChIKey
KRKNYBCHXYNGOX-LNLMKGTHSA-N
Chemical Structure
2D Structure
2D structure of 2-Hydroxy(~2~H_4_)propane-1,2,3-tricarboxylic acid
CAS: 147664-83-3
CID: 16213286
Formula: C6H8O7
MW: 196.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight196.15
XLogP3-1.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass196.05210957
Monoisotopic Mass196.05210957
Topological Polar Surface Area132 Ų
Heavy Atom Count13
Formal Charge0
Complexity227
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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DE2060Citric acid-D4
TRC-C521002-50MGCitric Acid-2,2,4,4-d4
RG-C092005-01Citric-2,2,4,4-D4 Acid
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B7297-500000Citric acid

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