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L-Phenylalanine-d1

CAT: 0804-HY-N0215S13-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N0215S13-01Size:5 mg
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Description
L-Phenylalanine-d is the deuterium labeled L-Phenylalanine. L-Phenylalanine ((S) -2-Amino-3-phenylpropionic acid) is an essential amino acid isolated from Escherichia coli. L-Phenylalanine is a α2δ subunit of voltage-dependent Ca+ channels antagonist with a Ki of 980 nM. L-phenylalanine is a competitive antagonist for the glycine- and glutamate-binding sites of N-methyl-D-aspartate receptors (NMDARs) (KB of 573 μM) and non-NMDARs, respectively. L-Phenylalanine is widely used in the production of food flavors and pharmaceuticals[1][2][3][4].
CAS Number
54793-54-3
Product Name Alternative
(S) -2-Amino-3-phenylpropionic acid-d1
UNSPSC
12352005
Target
Calcium Channel; Endogenous Metabolite; iGluR; Isotope-Labeled Compounds
Type
Isotope-Labeled Compounds
Related Pathways
Membrane Transporter/Ion Channel; Metabolic Enzyme/Protease; Neuronal Signaling; Others
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Purity
99.5
Solubility
10 mM in DMSO
Smiles
OC([C@@H](N)CC1=C([2H])C=CC=C1)=O
Molecular Formula
C9H10DNO2
Molecular Weight
166.20
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216.
Shipping Conditions
Room Temperature
Storage Conditions
RT, sealed storage, away from moisture and light
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported
Isoform
NMDA Receptor

Chemical Information

L-Phenylalanine-2-d1
CAS Number54793-54-3
PubChem CID10702212
IUPAC Name(2S)-2-amino-2-deuterio-3-phenylpropanoic acid
Molecular FormulaC9H11NO2
Molecular Weight166.19
XLogP-1.5
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity153
SMILES
[2H][C@](CC1=CC=CC=C1)(C(=O)O)N
InChI
InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1/i8D
InChIKey
COLNVLDHVKWLRT-ZXEPEWCSSA-N
Chemical Structure
2D Structure
2D structure of L-Phenylalanine-2-d1
CAS: 54793-54-3
CID: 10702212
Formula: C9H11NO2
MW: 166.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight166.19
XLogP3-1.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass166.085255340
Monoisotopic Mass166.085255340
Topological Polar Surface Area63.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity153
Isotope Atom Count1
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes