DL-threo-beta-Methylaspartate
DL-threo-beta-Methylaspartate synonyms
2-Amino-3-methylsuccinic acid; (2S, 3S)-3-methylaspartate; aspartic acid, 3-methyl-; DL-Aspartic acid, 3-methyl-; L-threo-3-methyl-aspartate; DL-threo-beta-Methylaspartic acid; 3-methylaspartate; DL-threo-b-Methylaspartic acid; beta-methylaspartate; L-threo-3-methylaspartate; DL-Aspartic acid, 3-methyl
Graphical representations:
View large 3D structure
Molecular Formula: C5H9NO4
Natural Isotopic Abundance Mass: 147.12926
Mono-Isotopic Molecular Masses:
- C12N14: 147.0531577825
- C13N14: 152.0699319715
- C12N15: 148.0501926757
- C13N15: 153.0669668647
InChI string: InChI=1S/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3+/m0/s1
PubChem Compound (CID): 852CAS Registry number: 31571-69-4 6667-60-3
Sigma-Aldrich: M6126_SIGMA
ChemIDplus: 006667603
ChemSpider: 13577644
BIND: 1081
ChemDB: 3966424
PDB Compound ID: 3MD ACB
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)