HMDB0240544
     RDKit          3D
N-Acetyl-S-methylcysteine
 22 21  0  0  0  0  0  0  0  0999 V2000
    3.0052    1.6299    0.7876 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7977    0.7142    1.7646 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2050   -0.7349    0.8262 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4238   -0.2820   -0.3801 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.7151    0.4996   -0.1266 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8241    0.0461    0.2981 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9007    1.1043    0.4916 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1576   -1.2497    0.5939 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0855   -1.4508   -1.2192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9654   -2.3188   -1.4616 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1589   -1.6310   -1.7516 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2259    1.0699   -0.1476 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5867    2.6454    0.5867 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9158    1.7583    1.4107 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6575   -1.4137    1.4743 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1244   -1.2968    0.5003 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1704    0.3700   -0.9718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5478    2.0823    0.1779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1752    1.0391    1.5627 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7820    0.7791   -0.0968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5599   -1.9390    0.9565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3420   -1.4213   -2.7246 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  3
  6  7  1  0
  6  8  1  0
  4  9  1  0
  9 10  2  0
  9 11  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  3 15  1  0
  3 16  1  0
  4 17  1  6
  7 18  1  0
  7 19  1  0
  7 20  1  0
  8 21  1  0
 11 22  1  0
M  END