Cas no 444309-84-6 (Glycyl-L-cysteinylglycylglycylglycylglycine)

Glycyl-L-cysteinylglycylglycylglycylglycine structure
444309-84-6 structure
Product Name:Glycyl-L-cysteinylglycylglycylglycylglycine
CAS No:444309-84-6
MF:C13H22N6O7S
MW:406.414781093597
CID:2643231
PubChem ID:71363051
Update Time:2025-04-21

Glycyl-L-cysteinylglycylglycylglycylglycine Chemical and Physical Properties

Names and Identifiers

    • 2-[[2-[[2-[[2-[[(2R)-2-[(2-aminoacetyl)amino]-3-sulfanylpropanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]acetic acid
    • DTXSID50786640
    • 444309-84-6
    • Glycyl-L-cysteinylglycylglycylglycylglycine
    • Inchi: 1S/C13H22N6O7S/c14-1-8(20)19-7(6-27)13(26)18-4-11(23)16-2-9(21)15-3-10(22)17-5-12(24)25/h7,27H,1-6,14H2,(H,15,21)(H,16,23)(H,17,22)(H,18,26)(H,19,20)(H,24,25)/t7-/m0/s1
    • InChI Key: DROHJRCTFFDAPU-ZETCQYMHSA-N
    • SMILES: SC[C@@H](C(NCC(NCC(NCC(NCC(=O)O)=O)=O)=O)=O)NC(CN)=O

Computed Properties

  • Exact Mass: 406.12706824Da
  • Monoisotopic Mass: 406.12706824Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 8
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 12
  • Complexity: 586
  • 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: -6.3
  • Topological Polar Surface Area: 210?2
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