HMDB0302622 RDKit 3D Dodecatrienoic acid 32 31 0 0 0 0 0 0 0 0999 V2000 -5.8435 -0.1401 -0.0826 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3544 0.1105 0.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5598 -1.1798 0.0318 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1042 -0.8960 0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5032 -0.0626 -0.9613 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1402 0.1846 -0.6882 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0663 0.4035 -0.4465 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9693 -0.8027 -0.2489 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1741 -0.5529 -0.0331 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -0.2847 0.2067 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9484 1.0113 0.2538 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3431 1.2551 0.5041 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1905 0.3736 0.6851 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7883 2.5945 0.5437 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2918 -0.3770 0.9241 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3510 0.7972 -0.4125 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1066 -0.9168 -0.8203 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1849 0.6593 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0842 0.6817 -0.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7753 -1.6774 -0.9629 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8773 -1.8586 0.8235 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5608 -1.8868 0.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8513 -0.3829 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6036 -0.7373 -1.8945 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1292 0.8205 -1.1559 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3667 1.5740 -0.6947 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5781 1.3606 -0.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4505 -1.7201 -0.3356 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4413 -1.9417 -0.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3167 -0.9965 0.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2438 1.7936 0.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6657 2.7939 0.0938 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 3 7 8 1 0 8 9 2 3 9 10 1 0 10 11 2 3 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 7 27 1 0 8 28 1 0 9 29 1 0 10 30 1 0 11 31 1 0 14 32 1 0 M END