HMDB0001280
     RDKit          3D
2-Aminomuconic acid semialdehyde
 17 16  0  0  0  0  0  0  0  0999 V2000
    2.1725   -0.9329   -0.4176 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1562    0.0340    0.0098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1010   -0.2824   -0.1762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1857    0.5713    0.1958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4640    0.2370    0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8567   -1.0083   -0.5993 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0995   -1.2202   -0.7356 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5934    1.2539    0.5991 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8753    2.1595    1.0062 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9738    1.4511    0.7324 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9955   -0.5156   -0.8776 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0975   -1.9333   -0.2845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2910   -1.2808   -0.6536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0151    1.5253    0.6516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2006    0.9886    0.3344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1378   -1.7350   -0.9218 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4871    0.6876    1.1364 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  2  8  1  0
  8  9  2  0
  8 10  1  0
  1 11  1  0
  1 12  1  0
  3 13  1  0
  4 14  1  0
  5 15  1  0
  6 16  1  0
 10 17  1  0
M  END