HMDB0059809 RDKit 3D 4-Hydroxy-benzenepropanedioate 22 22 0 0 0 0 0 0 0 0999 V2000 -3.7014 -0.8509 1.6245 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7626 -0.4404 0.4459 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6031 0.5975 0.1333 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9359 -1.0652 -0.6069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5961 -0.4682 -0.6136 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2808 0.4340 -1.3999 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5692 -0.8455 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6678 -0.2776 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6445 -0.9640 -0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 -0.5112 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2208 0.6827 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5073 1.2010 -0.0501 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.3802 0.7433 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9874 0.9036 0.8447 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4857 1.5355 0.5527 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3967 -0.8197 -1.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8975 -2.1867 -0.5094 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -1.9054 -1.0171 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7178 -1.0189 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1748 0.9255 0.6615 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4883 2.3244 1.2622 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1828 1.3693 1.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 2 0 14 8 1 0 3 15 1 0 4 16 1 0 4 17 1 0 9 18 1 0 10 19 1 0 12 20 1 0 13 21 1 0 14 22 1 0 M END