Glycyl-L-arginylglycyl-L-α-aspartyl-L-seryl-L-proline
C22H37N9O10
91037-75-1 Copyright (C) 2025 ACS
 41 41  0  0  1  0  0  0  0  0999 V2000
    3.9098    9.3358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6798   10.6695    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.6798    8.0022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2198   10.6695    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9098   12.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9898   12.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3698   12.0033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5298   12.0033    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.2198   13.3369    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2998   10.6695    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2998   13.3369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8398   10.6695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5298   14.6706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6098    9.3358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6098   12.0033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9898   14.6706    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2998   16.0044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1498    9.3358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.9198    8.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4598    8.0022    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.1498    6.6685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2298    6.6685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2298    9.3358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4598    5.3347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7698    9.3358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2298    4.0011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5398   10.6695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5398    8.0022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4598    2.6674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.0799   10.6695    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.2298    1.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4598    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.7698    1.3338    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9406    6.6254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9100    5.4809    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4468    6.3051    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3698    9.3358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4645    8.0900    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4645   10.5817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.5658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   10.1058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1 37  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  6  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  6  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  2  0  0  0  0
 13 16  1  0  0  0  0
 13 17  2  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  1  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  1  0  0  0  0
 25 28  2  0  0  0  0
 26 29  1  0  0  0  0
 27 30  1  0  0  0  0
 29 31  1  0  0  0  0
 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
 34 35  1  0  0  0  0
 34 36  2  0  0  0  0
 38 34  1  6  0  0  0
 37 38  1  0  0  0  0
 37 39  1  0  0  0  0
 38 40  1  0  0  0  0
 39 41  1  0  0  0  0
 40 41  1  0  0  0  0
M  END
> <cas.rn>
91037-75-1

> <cas.index.name>
L-Proline, glycyl-L-arginylglycyl-L-α-aspartyl-L-seryl-

> <molecular.formula>
C22H37N9O10

> <molecular.weight>
587.58

> <density.predicted>
1.655±0.14 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
3.313±0.20    Most Acidic Temp: 25 °C

$$$$
