HMDB0039106 RDKit 3D 2,4-Undecadiene-8,10-diynoic acid isobutylamide 36 35 0 0 0 0 0 0 0 0999 V2000 6.0113 3.3979 2.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 2.4274 1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1232 1.2760 1.1674 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7386 0.2961 0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2947 -0.8842 -0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0281 -1.4722 0.4798 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5987 -2.6562 -0.2773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4318 -2.7387 -0.8486 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4583 -1.6812 -0.7914 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7098 -1.8591 -1.4084 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7561 -0.8797 -1.4214 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8487 -1.1216 -2.0341 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6531 0.3687 -0.7829 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 1.3806 -0.7748 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9241 0.8107 -0.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9878 1.9157 -0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6164 0.4484 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3955 4.2578 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0982 -1.6179 -0.2338 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0118 -0.5973 -1.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3461 -1.8510 1.4905 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3333 -0.6540 0.5661 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3301 -3.4913 -0.3396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -3.6564 -1.4035 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6332 -0.7704 -0.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9056 -2.8053 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7592 0.5933 -0.2728 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3462 2.2616 -0.2023 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9674 1.6819 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3247 -0.0294 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9583 1.5198 0.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0374 2.3183 -1.1635 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6049 2.7122 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5476 0.2582 1.8697 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9306 -0.4307 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0194 1.2722 1.7777 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 2 3 1 0 3 4 3 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 1 18 1 0 5 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 7 23 1 0 8 24 1 0 9 25 1 0 10 26 1 0 13 27 1 0 14 28 1 0 14 29 1 0 15 30 1 0 16 31 1 0 16 32 1 0 16 33 1 0 17 34 1 0 17 35 1 0 17 36 1 0 M END