Cas no 63409-16-5 (Nopalinic acid)

Nopalinic acid structure
Nopalinic acid structure
Product Name:Nopalinic acid
CAS No:63409-16-5
MF:C10H18N2O6
MW:262.259723186493
CID:2018702
PubChem ID:4474580
Update Time:2025-04-21

Nopalinic acid Chemical and Physical Properties

Names and Identifiers

    • Nopalinic acid
    • N2-(1,3-Dicarboxypropyl)ornithine
    • CHEBI:133921
    • N-(4-Amino-1-carboxybutyl)glutamic acid, 9CI
    • N-(4-amino-1-carboxybutyl)glutamic acid
    • N-[(1S)-4-Amino-1-carboxybutyl]-D-glutamic acid
    • 63409-16-5
    • DTXSID001243308
    • Ornaline
    • C01683
    • UXZAXFPFSQRZOZ-UHFFFAOYSA-N
    • 2-[(4-amino-1-carboxybutyl)amino]pentanedioic acid
    • Inchi: 1S/C10H18N2O6/c11-5-1-2-6(9(15)16)12-7(10(17)18)3-4-8(13)14/h6-7,12H,1-5,11H2,(H,13,14)(H,15,16)(H,17,18)
    • InChI Key: UXZAXFPFSQRZOZ-UHFFFAOYSA-N
    • SMILES: OC(C(CCCN)NC(C(=O)O)CCC(=O)O)=O

Computed Properties

  • Exact Mass: 262.11648630g/mol
  • Monoisotopic Mass: 262.11648630g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 10
  • Complexity: 307
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -5.9
  • Topological Polar Surface Area: 150?2
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