Cas no 647823-69-6 (Lysine, 4-oxo-)

Lysine, 4-oxo- structure
Lysine, 4-oxo- structure
Product Name:Lysine, 4-oxo-
CAS No:647823-69-6
MF:C6H12N2O3
MW:160.171081542969
CID:417422
PubChem ID:45082345
Update Time:2025-04-19

Lysine, 4-oxo- Chemical and Physical Properties

Names and Identifiers

    • Lysine, 4-oxo-
    • Lysine, 4-oxo- (9CI)
    • SCHEMBL6831240
    • 4-keto-l-lysine
    • 647823-69-6
    • (2S)-2,6-diamino-4-oxohexanoic acid
    • OIMQYJJMDNKKOD-YFKPBYRVSA-N
    • 4-oxolysine
    • Inchi: 1S/C6H12N2O3/c7-2-1-4(9)3-5(8)6(10)11/h5H,1-3,7-8H2,(H,10,11)/t5-/m0/s1
    • InChI Key: OIMQYJJMDNKKOD-YFKPBYRVSA-N
    • SMILES: O=C(CCN)C[C@@H](C(=O)O)N

Computed Properties

  • Exact Mass: 160.08486
  • Monoisotopic Mass: 160.08479225g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 5
  • Complexity: 158
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -4.7
  • Topological Polar Surface Area: 106?2

Experimental Properties

  • PSA: 106.41
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