HMDB0036599 RDKit 3D Ethyl 2Z,4E-decadienoic acid 34 33 0 0 0 0 0 0 0 0999 V2000 5.1726 0.1408 -0.5044 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1647 1.1749 -0.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3967 0.7230 1.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6825 -0.5537 0.8109 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6791 -0.4214 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0736 -1.7482 -0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1991 -1.9729 -0.3657 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1202 -0.8930 -0.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4403 -1.1560 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4056 -0.1147 0.3808 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1041 1.0899 0.5482 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7383 -0.4679 0.4971 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6963 0.5164 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 1.5858 -0.2521 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 0.5986 -1.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6117 -0.3357 0.4082 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7194 -0.6538 -1.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5168 1.4090 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7532 2.0774 0.2125 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6578 1.4673 1.4476 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 0.5109 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0524 -0.8057 1.6992 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3597 -1.3987 0.5829 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2636 -0.1562 -1.2864 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0189 0.4155 -0.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7728 -2.5669 -0.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5923 -3.0086 -0.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8744 0.1372 0.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7279 -2.1845 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6828 0.0108 0.8268 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5308 0.9186 1.8226 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6962 2.5946 0.2314 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6320 1.5274 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 1.5397 -0.9355 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 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 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 7 27 1 0 8 28 1 0 9 29 1 0 13 30 1 0 13 31 1 0 14 32 1 0 14 33 1 0 14 34 1 0 M END