KEGG:C04692  2-[3-Carboxy-3-(methylammonio)propyl]-L-histidine
  ISISHOST03240423112D 1   1.00000     0.00000  4059
 19 19  0     1  0            999 V2000
    6.3357   -6.4009    0.0000 C   0  0  0  0  0  0           0  0  0
    5.6322   -5.9974    0.0000 C   0  0  0  0  0  0           0  0  0
    6.3357   -7.1388    0.0000 C   0  0  0  0  0  0           0  0  0
    7.6184   -6.4009    0.0000 N   0  0  0  0  0  0           0  0  0
    4.9253   -6.4009    0.0000 C   0  0  1  0  0  0           0  0  0
    6.9736   -7.5078    0.0000 N   0  0  0  0  0  0           0  0  0
    7.6184   -7.1388    0.0000 C   0  0  0  0  0  0           0  0  0
    4.2253   -5.9974    0.0000 C   0  0  0  0  0  0           0  0  0
    4.9253   -7.2147    0.0000 N   0  0  0  0  0  0           0  0  0
    3.5184   -6.4009    0.0000 O   0  0  0  0  0  0           0  0  0
    4.2253   -5.1802    0.0000 O   0  0  0  0  0  0           0  0  0
    8.3192   -7.5465    0.0000 C   0  0  0  0  0  0           0  0  0
    9.0292   -7.1333    0.0000 C   0  0  0  0  0  0           0  0  0
    9.7417   -7.5417    0.0000 C   0  0  3  0  0  0           0  0  0
   10.4542   -7.1292    0.0000 C   0  0  0  0  0  0           0  0  0
    9.7435   -8.3667    0.0000 N   0  3  0  0  0  0           0  0  0
   11.1691   -7.5408    0.0000 O   0  0  0  0  0  0           0  0  0
   10.4532   -6.3042    0.0000 O   0  0  0  0  0  0           0  0  0
    9.0299   -8.7807    0.0000 C   0  0  0  0  0  0           0  0  0
  5  9  1  6     0  0
  8 10  1  0     0  0
  8 11  2  0     0  0
  6  7  1  0     0  0
  7 12  1  0     0  0
  1  2  1  0     0  0
 12 13  1  0     0  0
  1  3  2  0     0  0
 13 14  1  0     0  0
  1  4  1  0     0  0
 14 15  1  0     0  0
  2  5  1  0     0  0
 14 16  1  0     0  0
  3  6  1  0     0  0
 15 17  1  0     0  0
  4  7  2  0     0  0
 15 18  2  0     0  0
  5  8  1  0     0  0
 16 19  1  0     0  0
M  CHG  1  16   1
M  END