CAS 1231709-25-3

4-(1,1-Dimethylethyl) hydrogen 2-methyl-D-aspartate

Description:

4-(1,1-Dimethylethyl) hydrogen 2-methyl-D-aspartate, identified by its CAS number 1231709-25-3, is a chemical compound that belongs to the class of amino acids, specifically a derivative of aspartate. This compound features a tert-butyl group, which contributes to its hydrophobic characteristics, and a methyl group that influences its steric properties. The presence of the hydrogen atom indicates that it is a salt form of the amino acid, which can affect its solubility and reactivity in biological systems. This compound is of interest in biochemical research, particularly in studies related to neurotransmission and receptor activity, as aspartate is a key excitatory neurotransmitter in the central nervous system. Its structural modifications may also impact its interaction with various biological targets, making it a subject of investigation in pharmacology and medicinal chemistry. Overall, the unique structural features of this compound suggest potential applications in drug development and neurobiology.

Formula: C₉H₁₇NO₄

InChI: InChI=1S/C9H17NO4/c1-8(2,3)14-6(11)5-9(4,10)7(12)13/h5,10H2,1-4H3,(H,12,13)/t9-/m1/s1

InChI key: InChIKey=VIQZVYPYYUPDQY-SECBINFHSA-N

SMILES: C(C[C@@](C(O)=O)(C)N)(OC(C)(C)C)=O

Synonyms:

• D-Aspartic acid, 2-methyl-, 4-(1,1-dimethylethyl) ester
• 4-(1,1-Dimethylethyl) hydrogen 2-methyl-D-aspartate
• (2R)-2-Amino-4-(tert-butoxy)-2-methyl-4-oxobutanoic acid
• (R)-α-MethyLaspartic acid-4-(tert-butyl) ester