(S)-2,6-Diaminohexanoic acid compound with (S)-2-aminopentanedioic acid (1:1) - ≥95% , CAS No.5408-52-6

CAS: 5408-52-6 Cat. No.: S193835 Molecular Weight: 293.32 EC Number: 226-474-0 PubChem CID: 79415

GRADE & PURITY ≥95%

Synonyms

C11H23N3O6 | NSC-10855 | L-LYSINE L-GLUTAMATE [MI] | DTXSID50883926 | L-Lysine L-glutamate salt | (2S)-2,6-diaminohexanoic acid; (2S)-2-aminopentanedioic acid | 3Z47P7XZ8D | PGAL | SCHEMBL205003 | (S)-2,6-Diaminohexanoicacidcompoundwith(S)-2-aminopentaned

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

C11H23N3O6 | NSC-10855 | L-LYSINE L-GLUTAMATE [MI] | DTXSID50883926 | L-Lysine L-glutamate salt | (2S)-2, 6-diaminohexanoic acid; (2S)-2-aminopentanedioic acid | 3Z47P7XZ8D | PGAL | SCHEMBL205003 | (S)-2, 6-Diaminohexanoicacidcompoundwith(S)-2-aminopentaned

Specifications & Purity

≥95%

Storage

Store at 2-8°C, Protected from light, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 488185725
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185725
• Canonical Smiles: C(CCN)CC(C(=O)O)N.C(CC(=O)O)C(C(=O)O)N
• IUPAC Name: (2S)-2-aminopentanedioic acid;(2S)-2,6-diaminohexanoic acid
• InChIKey: HOMROMWVNDUGRI-RVZXSAGBSA-N
• INCHI: 1S/C6H14N2O2.C5H9NO4/c7-4-2-1-3-5(8)6(9)10;6-3(5(9)10)1-2-4(7)8/h5H,1-4,7-8H2,(H,9,10);3H,1-2,6H2,(H,7,8)(H,9,10)/t5-;3-/m00/s1
• Isomeric SMILES: C(CCN)C[C@@H](C(=O)O)N.C(CC(=O)O)[C@@H](C(=O)O)N
• PubChem CID: 79415
• Molecular Weight: 293.32

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 Medium-chain fatty acids Amino fatty acids Dicarboxylic acids and derivatives Amino acids Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Glutamic acid or derivatives - Alpha-amino acid - L-alpha-amino acid - Medium-chain fatty acid - Amino fatty acid - Dicarboxylic acid or derivatives - Fatty acid - Fatty acyl - Amino acid - Carboxylic acid - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organopnictogen compound - 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: Light sensitive
• Molecular Weight: 293.320 g/mol
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 9
• Exact Mass: 293.159 Da
• Monoisotopic Mass: 293.159 Da
• Topological Polar Surface Area: 190.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 251.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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: 2

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