Cas no 64855-91-0 (Pyrglutargine)

Pyrglutargine structure
Pyrglutargine structure
Product Name:Pyrglutargine
CAS No:64855-91-0
MF:C11H21N5O5
MW:303.314942121506
CID:505066
PubChem ID:6454976
Update Time:2025-04-19

Pyrglutargine Chemical and Physical Properties

Names and Identifiers

    • Pyrglutargine
    • Argininpyroglutamat
    • VYI1WK838B
    • 5-Oxo-DL-proline, compound with L-arginine (1:1)
    • Arginine pyroglutamate
    • (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid;5-oxopyrrolidine-2-carboxylic acid
    • 64855-91-0
    • SCHEMBL1005517
    • Pirglutargina
    • L-ARGININE DL-PYROGLUTAMATE
    • EINECS 265-253-3
    • G-278
    • PIRGLUTARGINE [MART.]
    • PIRGLUTARGINE
    • PIRGLUTARGINE [WHO-DD]
    • DTXSID90215141
    • AKOS037643287
    • Q-100651
    • AS-12651
    • UNII-VYI1WK838B
    • Inchi: 1S/C6H14N4O2.C5H7NO3/c7-4(5(11)12)2-1-3-10-6(8)9;7-4-2-1-3(6-4)5(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);3H,1-2H2,(H,6,7)(H,8,9)/t4-;/m0./s1
    • InChI Key: UYCAGRPOUWSBIQ-WCCKRBBISA-N
    • SMILES: O=C1CCC(C(=O)O)N1.OC([C@H](CCC/N=C(\N)/N)N)=O

Computed Properties

  • Exact Mass: 303.15426879g/mol
  • Monoisotopic Mass: 303.15426879g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 6
  • Complexity: 331
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 194?2
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