Cas no 125464-46-2 (L-Lysine, L-a-aspartyl-L-seryl-L-a-aspartylglycyl- (9CI))

L-Lysine, L-a-aspartyl-L-seryl-L-a-aspartylglycyl- (9CI) structure
125464-46-2 structure
Product Name:L-Lysine, L-a-aspartyl-L-seryl-L-a-aspartylglycyl- (9CI)
CAS No:125464-46-2
MF:C19H32N6O11
MW:520.490984916687
CID:166049
PubChem ID:130454
Update Time:2025-04-19

L-Lysine, L-a-aspartyl-L-seryl-L-a-aspartylglycyl- (9CI) Chemical and Physical Properties

Names and Identifiers

    • L-Lysine, L-a-aspartyl-L-seryl-L-a-aspartylglycyl- (9CI)
    • (2S)-6-amino-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]acetyl]amino]hexanoic acid
    • aspartyl-seryl-aspartyl-glycyl-lysine
    • Asp-ser-asp-gly-lys
    • DSDGK
    • L-alpha-aspartyl-L-seryl-L-alpha-aspartylglycyl-L-lysine
    • L-Lysine, N2-(N-(N-(N-L-alpha-aspartyl-L-seryl)-L-alpha-aspartyl)glycyl)-
    • 125464-46-2
    • DTXSID70154781
    • H-Asp-Ser-Asp-Gly-Lys-OH
    • Inchi: 1S/C19H32N6O11/c20-4-2-1-3-10(19(35)36)23-13(27)7-22-17(33)11(6-15(30)31)24-18(34)12(8-26)25-16(32)9(21)5-14(28)29/h9-12,26H,1-8,20-21H2,(H,22,33)(H,23,27)(H,24,34)(H,25,32)(H,28,29)(H,30,31)(H,35,36)/t9-,10-,11-,12-/m0/s1
    • InChI Key: YTXBJGMYOPYBAT-BJDJZHNGSA-N
    • SMILES: OC([C@H](CCCCN)NC(CNC([C@H](CC(=O)O)NC([C@H](CO)NC([C@H](CC(=O)O)N)=O)=O)=O)=O)=O

Computed Properties

  • Exact Mass: 520.21306
  • Monoisotopic Mass: 520.21290586g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 10
  • Hydrogen Bond Acceptor Count: 13
  • Heavy Atom Count: 36
  • Rotatable Bond Count: 18
  • Complexity: 822
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -9.7
  • Topological Polar Surface Area: 301?2

Experimental Properties

  • PSA: 300.57

L-Lysine, L-a-aspartyl-L-seryl-L-a-aspartylglycyl- (9CI) Related Literature

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