HMDB0094792 RDKit 3D 3,5-octadienoylglycine 29 28 0 0 0 0 0 0 0 0999 V2000 4.6117 -0.9810 1.7446 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9143 -0.4421 0.4857 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7315 -1.2595 0.1791 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5256 -0.7948 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1941 0.6096 0.4715 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0101 0.9766 0.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3693 1.3910 0.4331 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8537 1.1497 -1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2161 2.0206 -1.9487 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6559 0.3503 -1.3967 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4768 -0.6426 -0.9206 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -0.6548 -1.4967 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2890 0.2588 -2.2373 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6799 -1.7195 -1.1777 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5692 -0.4649 1.9178 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8502 -2.0372 1.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9618 -0.7954 2.6072 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8086 0.6326 0.5263 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6884 -0.6005 -0.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -2.3256 -0.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7086 -1.4890 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0398 1.2543 0.6948 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4052 2.2870 0.7396 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9684 0.6051 1.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6956 2.3758 0.7351 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1727 2.0349 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5868 -0.5933 0.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0835 -1.6725 -1.1823 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0054 -1.8883 -0.2133 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 2 3 6 7 1 0 7 8 1 0 8 9 1 0 8 10 2 3 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 1 15 1 0 1 16 1 0 1 17 1 0 2 18 1 0 2 19 1 0 3 20 1 0 4 21 1 0 5 22 1 0 6 23 1 0 7 24 1 0 7 25 1 0 9 26 1 0 11 27 1 0 11 28 1 0 14 29 1 0 M END