HMDB0010729 RDKit 3D trans-Dodec-2-enoic acid 36 35 0 0 0 0 0 0 0 0999 V2000 -3.7521 -1.6790 -0.7282 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9926 -0.2529 -1.1014 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7267 0.5782 -1.0663 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1114 0.5810 0.3206 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8582 1.4166 0.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2048 1.4633 1.6577 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1704 0.0722 2.1029 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1131 -0.5805 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3633 0.2235 1.0248 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3406 -0.4145 0.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7543 0.2211 -1.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7082 -0.3832 -1.9536 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0976 0.2274 -2.9718 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2083 -1.6605 -1.7441 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0717 -2.1960 -1.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3785 -1.8114 0.2948 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7225 -2.2114 -0.7882 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4504 -0.2144 -2.1065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6897 0.1849 -0.3466 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0087 0.1290 -1.7791 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9418 1.6088 -1.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8515 1.0025 1.0282 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8132 -0.4563 0.5863 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1486 2.4373 -0.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1392 1.0601 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.8282 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6716 2.1372 1.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7454 -0.5253 2.3021 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6947 0.1264 3.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3163 -1.6015 1.5487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6294 -0.7215 0.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1274 1.2317 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8533 0.2665 2.0159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6993 -1.4096 0.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3786 1.2140 -1.1872 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4167 -1.8916 -0.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 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 9 10 1 0 10 11 2 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 3 21 1 0 4 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 6 27 1 0 7 28 1 0 7 29 1 0 8 30 1 0 8 31 1 0 9 32 1 0 9 33 1 0 10 34 1 0 11 35 1 0 14 36 1 0 M END