HMDB0244715
     RDKit          3D
beta-N-Methylamino-L-alanine
 18 17  0  0  0  0  0  0  0  0999 V2000
    2.6523    0.7572   -0.1966 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4670    0.2307    0.4258 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3837    0.0267   -0.5109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7932   -0.5261    0.2686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2251    0.3709    1.3023 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9159   -0.8897   -0.6232 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8099   -1.6582   -1.6046 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1638   -0.3536   -0.3662 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3386    1.2604   -1.1368 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0935    1.5539    0.4439 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3434   -0.0854   -0.3750 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6382   -0.6170    0.9874 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7202   -0.6573   -1.2982 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1052    1.0127   -0.9322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4880   -1.4798    0.7833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1086    0.8328    1.0496 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4788    1.0774    1.5032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7588   -0.8556    0.2797 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
  4  6  1  0
  6  7  2  0
  6  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  3 13  1  0
  3 14  1  0
  4 15  1  0
  5 16  1  0
  5 17  1  0
  8 18  1  0
M  END