HMDB0094800 RDKit 3D 6,7-octadienoylglycine 29 28 0 0 0 0 0 0 0 0999 V2000 -4.8488 1.7689 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3829 0.6209 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8222 -0.4881 -0.7274 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3463 -0.5046 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8751 -1.2127 0.4776 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3775 -1.3034 0.5697 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2839 0.0555 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7454 -0.1712 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -0.8691 1.7944 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5149 0.2695 -0.2512 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9402 0.0282 -0.1261 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7173 1.1401 -0.7564 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9566 1.0821 -0.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1127 2.2209 -1.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0323 2.4829 -0.6698 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9837 1.8417 1.1508 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 -1.2570 -0.9752 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9693 -1.1169 -1.6331 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9346 0.5110 -0.8714 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2703 -0.6987 1.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2701 -2.2438 0.4338 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0229 -1.9196 -0.2346 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1411 -1.8107 1.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0608 0.5582 -0.3515 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0042 0.6378 1.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8325 -1.6899 1.6163 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2059 -0.0861 0.9404 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1475 -0.9206 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9644 3.0748 -0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 1 0 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 3 17 1 0 4 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 6 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