Cas no 223538-37-2 (L-Aspartic acid, L-isoleucyl-L-a-glutamyl-L-prolyl-)

L-Aspartic acid, L-isoleucyl-L-a-glutamyl-L-prolyl- structure
223538-37-2 structure
Product Name:L-Aspartic acid, L-isoleucyl-L-a-glutamyl-L-prolyl-
CAS No:223538-37-2
MF:C20H32N4O9
MW:472.489485740662
CID:1407761
Update Time:2024-08-15

L-Aspartic acid, L-isoleucyl-L-a-glutamyl-L-prolyl- Chemical and Physical Properties

Names and Identifiers

    • L-Aspartic acid, L-isoleucyl-L-a-glutamyl-L-prolyl-
    • L-Aspartic acid, L-isoleucyl-L-α-glutamyl-L-prolyl-
    • Inchi: 1S/C20H32N4O9/c1-3-10(2)16(21)18(30)22-11(6-7-14(25)26)19(31)24-8-4-5-13(24)17(29)23-12(20(32)33)9-15(27)28/h10-13,16H,3-9,21H2,1-2H3,(H,22,30)(H,23,29)(H,25,26)(H,27,28)(H,32,33)/t10-,11-,12-,13-,16-/m0/s1
    • InChI Key: HQVYPYUOYDAWMF-YTORKDELSA-N
    • SMILES: C(O)(=O)[C@H](CC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(O)=O)NC(=O)[C@H]([C@@H](C)CC)N

Computed Properties

  • Exact Mass: 514.22762

Experimental Properties

  • Density: 1.372±0.06 g/cm3(Predicted)
  • Boiling Point: 845.6±65.0 °C(Predicted)
  • PSA: 219.51
  • pka: 3.45±0.23(Predicted)
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