HMDB0033791 RDKit 3D (E)-3-Hexadecenoic acid 48 47 0 0 0 0 0 0 0 0999 V2000 6.7016 -0.3129 0.7901 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7299 -0.2725 -0.3686 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9916 1.0430 -0.3919 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 1.2811 0.8633 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1618 0.2180 1.1068 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1912 0.1797 -0.0352 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1418 -0.8894 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -0.8778 -0.9714 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9007 -1.9042 -0.8588 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7393 -1.6706 0.3626 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4054 -0.3326 0.3933 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3513 -0.1190 -0.7993 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4118 -1.1192 -0.8304 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6763 -0.8051 -0.7645 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 0.5519 -0.6552 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9561 0.7290 0.6036 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0775 -0.2602 1.3542 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5511 1.9164 0.9802 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2354 -0.5168 1.7521 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3163 0.6090 0.8344 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3971 -1.1777 0.5848 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0594 -1.1373 -0.2592 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2914 -0.3645 -1.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3518 1.0997 -1.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7445 1.8534 -0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8548 1.3774 1.7356 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6735 2.2526 0.7364 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5998 -0.7519 1.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 0.5531 2.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6763 1.1823 -0.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6528 0.0046 -1.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6513 -1.8642 0.3442 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6204 -0.6271 1.1518 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2034 0.1533 -1.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -1.0485 -1.8971 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3994 -2.8962 -0.6965 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4709 -1.9333 -1.8074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4801 -2.5088 0.5203 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0684 -1.7473 1.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6222 0.4500 0.4051 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -0.2346 1.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7024 -0.3286 -1.7057 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6246 0.9243 -0.7752 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1089 -2.1843 -0.9138 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4079 -1.6402 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4999 1.3774 -0.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9745 0.6570 -1.4677 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0505 2.7185 1.3407 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 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 14 45 1 0 15 46 1 0 15 47 1 0 18 48 1 0 M END