HMDB0304086 RDKit 3D 2-succinyl-5-enolpyruvyl-6-hydroxy-3-cyclohexene-1-carboxylate 36 36 0 0 0 0 0 0 0 0999 V2000 -4.7075 0.3621 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8496 1.1403 -0.1027 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8988 0.6387 0.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6181 0.1807 0.4974 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6811 1.1830 -0.1121 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6609 0.5765 -0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9025 -0.6995 -0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3047 -1.1016 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6251 -2.2886 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3914 -0.1138 -0.4422 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9846 0.4995 0.7832 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0181 1.4637 0.3756 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7329 2.4088 -0.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3323 1.3542 0.8329 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.1193 -1.7076 0.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0724 -3.0350 -0.2729 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4175 -3.3861 -1.3554 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8277 -3.9766 0.4092 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.4590 -1.1020 -0.2581 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4735 -2.0224 -0.0682 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9497 2.5784 -0.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 3.0298 -1.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0612 3.4062 0.3329 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.7338 -0.7358 -0.6307 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4615 0.8149 -1.3628 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -0.0063 1.5463 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9763 1.4223 -1.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 2.1507 0.4349 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4798 1.2868 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1242 0.5848 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2355 -0.7417 -0.8901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2032 0.9966 1.4041 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4256 -0.3063 1.4022 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3328 -1.7211 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3343 -0.9011 -1.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -2.2325 0.8904 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 7 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 15 19 1 0 19 20 1 0 2 21 1 0 21 22 2 0 21 23 1 0 19 4 1 0 1 24 1 0 1 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 6 29 1 0 10 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 15 34 1 0 19 35 1 0 20 36 1 0 M CHG 3 14 -1 18 -1 23 -1 M END