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L-Citrulline-d7

CAT: 0804-HY-N0391S5-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N0391S5-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
L-Citrulline-d7 is the deuterium labeled L-Citrulline. L-Citrulline is an amino acid derived from ornithine in the catabolism of proline or glutamine and glutamate, or from l-arginine via arginine-citrulline pathway.
CAS Number
2483831-24-7
UNSPSC
12352211
Target
Endogenous Metabolite; Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Metabolic Enzyme/Protease; Others
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Others
Purity
99.83
Solubility
10 mM in DMSO|H2O : ≥ 50mg/mL
Smiles
O=C(O)C(N)([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])NC(N)=O
Molecular Formula
C6H6D7N3O3
Molecular Weight
182.23
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216. |[2]Fleszar MG, et al. Quantitative Analysis of l-Arginine, Dimethylated Arginine Derivatives, l-Citrulline, and Dimethylamine in Human Serum Using Liquid Chromatography-Mass Spectrometric Method. Chromatographia. 2018;81 (6) :911-921.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

L-Citrulline-2,3,3,4,4,5,5-D7
CAS Number2483831-24-7
PubChem CID171042818
IUPAC Name2-amino-5-(carbamoylamino)-2,3,3,4,4,5,5-heptadeuteriopentanoic acid
Molecular FormulaC6H13N3O3
Molecular Weight182.23
XLogP-4.3
Topological Polar Surface Area118
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity171
SMILES
[2H]C([2H])(C([2H])([2H])C([2H])(C(=O)O)N)C([2H])([2H])NC(=O)N
InChI
InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/i1D2,2D2,3D2,4D
InChIKey
RHGKLRLOHDJJDR-VNEWRNQKSA-N
Chemical Structure
2D Structure
2D structure of L-Citrulline-2,3,3,4,4,5,5-D7
CAS: 2483831-24-7
CID: 171042818
Formula: C6H13N3O3
MW: 182.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight182.23
XLogP3-4.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass182.13962851
Monoisotopic Mass182.13962851
Topological Polar Surface Area118 Ų
Heavy Atom Count12
Formal Charge0
Complexity171
Isotope Atom Count7
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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