Cilastatin sodium
C16H26N2O5S.Na
81129-83-1 Copyright (C) 2024 ACS
 25 24  0  0  0  0  0  0  0  0999 V2000
   10.6695    3.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3359    4.6200    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.6695    2.3100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0022    3.8500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6686    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0022    2.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6686    6.1600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3359    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6686    1.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3348    6.9300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3348    8.4701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011    9.2401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011   10.7801    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6675   11.5501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6675   13.0901    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.3338   13.8601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0011   13.8601    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   13.0901    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3338   15.4001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9905    5.1467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8107    3.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0033    4.6200    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.5433    4.6200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7733    5.9537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4952    0.0000    0.0000 Na  0  0  0  0  0 15  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
 22  1  1  1  0  0  0
  2  4  1  0  0  0  0
  4  5  2  0  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
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  1  0  0  0
 16 18  1  0  0  0  0
 16 19  2  0  0  0  0
 20 23  1  0  0  0  0
 21 23  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 23 24  1  0  0  0  0
M  END
> <cas.rn>
81129-83-1

> <cas.index.name>
2-Heptenoic acid, 7-[[(2R)-2-amino-2-carboxyethyl]thio]-2-[[[(1S)-2,2-dimethylcyclopropyl]carbonyl]amino]-, sodium salt (1:1), (2Z)-

> <molecular.formula>
C16H26N2O5S.Na

> <molecular.weight>
381.44

$$$$
