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α-Methyl-DL-aspartic acid

CAT: 0804-HY-W142119-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W142119-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
α-Methyl-DL-aspartic acid is a specific inhibitor of argininosuccinate synthase (ASS), and also is the rate-limiting enzyme for the recycling of 1-citrulline to 1-arginine[1].
CAS Number
2792-66-7
UNSPSC
12352209
Hazard Statement
H315, H319
Target
Ser/Thr Protease
Type
Peptides
Related Pathways
Metabolic Enzyme/Protease
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/α-methyl-dl-aspartic-acid.html
Purity
99.93
Solubility
H2O : 50 mg/mL (ultrasonic)
Smiles
CC(N)(C(O)=O)CC(O)=O
Molecular Formula
C5H9NO4
Molecular Weight
147.13
Precautions
H315, H319
References & Citations
[1]Asami Mori, et al. l-Citrulline dilates rat retinal arterioles via nitric oxide- and prostaglandin-dependent pathways in vivo. J Pharmacol Sci. 2015 Apr;127 (4) :419-23.|[2]Juliano R Guerreiro, et al. Argininosuccinate synthetase is a functional target for a snake venom anti-hypertensive peptide: role in arginine and nitric oxide production. J Biol Chem. 2009 Jul 24;284 (30) :20022-33.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Peptides
Clinical Information
No Development Reported

Chemical Information

2-Methylaspartic acid

RN given refers to cpd without isomeric designation

CAS Number2792-66-7
PubChem CID2109
IUPAC Name2-amino-2-methylbutanedioic acid
Molecular FormulaC5H9NO4
Molecular Weight147.13
XLogP-3.7
Topological Polar Surface Area101
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count10
Formal Charge0
Complexity167
SMILES
CC(CC(=O)O)(C(=O)O)N
InChI
InChI=1S/C5H9NO4/c1-5(6,4(9)10)2-3(7)8/h2,6H2,1H3,(H,7,8)(H,9,10)
InChIKey
CWAYDJFPMMUKOI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methylaspartic acid
CAS: 2792-66-7
CID: 2109
Formula: C5H9NO4
MW: 147.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight147.13
XLogP3-3.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass147.05315777
Monoisotopic Mass147.05315777
Topological Polar Surface Area101 Ų
Heavy Atom Count10
Formal Charge0
Complexity167
Isotope Atom Count0
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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