L-Glutamic acid-15N - ≥98 atom%,≥98% , CAS No.21160-87-2

CAS: 21160-87-2 Cat. No.: G117739 Molecular Weight: 148.12

GRADE & PURITY ≥98 atom%,≥98%

Synonyms

L-glutamic-15N acid | SCHEMBL1332144 | L-Glutamic acid-15N | L-Glutamic acid-15N, 98 atom % 15N | (2S)-2-(15N)Azanylpentanedioic acid | AKOS040757305 | WAA16087 | DTXSID80449110 | L-Glutamic acid-15N,2,3,3,4,4-d5, 97 atom % D, 98 atom % 15N, 95% (CP) | HY

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

L-glutamic-15N acid | SCHEMBL1332144 | L-Glutamic acid-15N | L-Glutamic acid-15N, 98 atom % 15N | (2S)-2-(15N)Azanylpentanedioic acid | AKOS040757305 | WAA16087 | DTXSID80449110 | L-Glutamic acid-15N, 2, 3, 3, 4, 4-d5, 97 atom % D, 98 atom % 15N, 95% (CP) | HY

Specifications & Purity

≥98 atom%, ≥98%

Storage

Room temperature, Argon charged

Shipped In

Normal

Action Type

ACTIVATOR

Purity

≥98 atom%, ≥98%

Names and Identifiers

• Canonical Smiles: C(CC(=O)O)C(C(=O)O)N
• IUPAC Name: (2S)-2-(15N)azanylpentanedioic acid
• InChIKey: WHUUTDBJXJRKMK-OGWWSMAPSA-N
• INCHI: 1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1/i6+1
• Isomeric SMILES: C(CC(=O)O)[C@@H](C(=O)O)[15NH2]
• WGK Germany: 3
• Molecular Weight: 148.12
• Reaxy-Rn: 1723799
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1723799&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Glutamic acid and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Glutamic acid and derivatives
• Alternative Parents: L-alpha-amino acids Amino fatty acids Dicarboxylic acids and derivatives Amino acids Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Glutamic acid or derivatives - Alpha-amino acid - L-alpha-amino acid - Amino fatty acid - Dicarboxylic acid or derivatives - Fatty acid - Fatty acyl - Amino acid - Carboxylic acid - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as glutamic acid and derivatives. These are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: Moisture sensitive
• Melt Point(°C): 205 °C
• Molecular Weight: 148.120 g/mol
• XLogP3: -3.700
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 148.05 Da
• Monoisotopic Mass: 148.05 Da
• Topological Polar Surface Area: 101.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 145.000
• Isotope Atom Count: 1
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

1. Zhu Yan, Di Lei, Cheng Shengyu, Jin Yueying, Zhang Minghui, Zhang Lingli, Wang Xin, Li Xi-Ling, Han Yu, Xu Chun-Yan, Min Jun Zhe.  (2023)  Simultaneous quantification of five DL-amino acids in beer by UHPLC–MS/MS using a novel chiral mass spectrometry probe.  EUROPEAN FOOD RESEARCH AND TECHNOLOGY,  249  (4): (1137-1146).  [PMID:] [10.1007/s00217-023-04203-2]