HMDB0304904 RDKit 3D 24 24 0 0 0 0 0 0 0 0999 V2000 1.2955 0.0747 0.8392 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6465 -0.3513 -0.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6928 -0.4377 -1.4224 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6438 0.0408 -0.9846 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1618 1.2728 -1.3171 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4089 1.7050 -0.9008 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1976 0.8803 -0.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 1.2886 0.3216 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6887 -0.3550 0.2283 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4409 -0.7797 -0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9688 -2.0333 0.1741 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -0.7440 -0.4532 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0272 -0.6299 0.8694 S 0 0 0 0 0 6 0 0 0 0 0 0 3.2740 -0.2903 2.1445 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8364 -1.8783 1.0382 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1153 0.6096 0.5064 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0607 0.1268 -2.3042 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6748 -1.5060 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5343 1.9115 -1.9368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7879 2.6902 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9853 0.6662 0.8852 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3189 -1.0050 0.8558 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5551 -2.6190 0.7495 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5599 1.3631 0.1544 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 2 12 1 0 12 13 1 0 13 14 2 0 13 15 2 0 13 16 1 0 10 4 1 0 3 17 1 0 3 18 1 0 5 19 1 0 6 20 1 0 8 21 1 0 9 22 1 0 11 23 1 0 16 24 1 0 M END