Cas no 627863-65-4 (Glycine, glycyl-L-lysylglycylglycyl-L-lysylglycyl-L-leucylglycyl-L-lysylglycyl-)

Glycine, glycyl-L-lysylglycylglycyl-L-lysylglycyl-L-leucylglycyl-L-lysylglycyl- structure
627863-65-4 structure
Product Name:Glycine, glycyl-L-lysylglycylglycyl-L-lysylglycyl-L-leucylglycyl-L-lysylglycyl-
CAS No:627863-65-4
MF:C38H70N14O12
MW:915.049007892609
CID:431334
PubChem ID:71382802
Update Time:2025-04-19

Glycine, glycyl-L-lysylglycylglycyl-L-lysylglycyl-L-leucylglycyl-L-lysylglycyl- Chemical and Physical Properties

Names and Identifiers

    • Glycine, glycyl-L-lysylglycylglycyl-L-lysylglycyl-L-leucylglycyl-L-lysylglycyl-
    • 2-[[2-[[(2S)-6-amino-2-[[2-[[(2S)-2-[[2-[[(2S)-6-amino-2-[[2-[[2-[[(2S)-6-amino-2-[(2-aminoacetyl)amino]hexanoyl]amino]acetyl]amino]acetyl]amino]hexanoyl]amino]acetyl]amino]-4-methylpentanoyl]amino]ac
    • DTXSID80805171
    • 627863-65-4
    • Glycyl-L-lysylglycylglycyl-L-lysylglycyl-L-leucylglycyl-L-lysylglycylglycine
    • Inchi: 1S/C38H70N14O12/c1-23(2)15-27(38(64)48-20-32(57)51-25(10-4-7-13-40)36(62)46-18-30(55)44-22-34(59)60)52-33(58)21-47-37(63)26(11-5-8-14-41)50-31(56)19-43-29(54)17-45-35(61)24(9-3-6-12-39)49-28(53)16-42/h23-27H,3-22,39-42H2,1-2H3,(H,43,54)(H,44,55)(H,45,61)(H,46,62)(H,47,63)(H,48,64)(H,49,53)(H,50,56)(H,51,57)(H,52,58)(H,59,60)/t24-,25-,26-,27-/m0/s1
    • InChI Key: ZWTANIOQNAQSDF-FWEHEUNISA-N
    • SMILES: O=C([C@H](CC(C)C)NC(CNC([C@H](CCCCN)NC(CNC(CNC([C@H](CCCCN)NC(CN)=O)=O)=O)=O)=O)=O)NCC(N[C@H](C(NCC(NCC(=O)O)=O)=O)CCCCN)=O

Computed Properties

  • Exact Mass: 914.5303
  • Monoisotopic Mass: 914.52976372g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 15
  • Hydrogen Bond Acceptor Count: 16
  • Heavy Atom Count: 64
  • Rotatable Bond Count: 35
  • Complexity: 1550
  • 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: -7.7
  • Topological Polar Surface Area: 432?2

Experimental Properties

  • PSA: 432.38
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