HMDB0241484 RDKit 3D (10Z,12E)-Hexadecadienoylcarnitine 69 68 0 0 0 0 0 0 0 0999 V2000 10.4292 1.0124 0.0264 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4176 0.8645 1.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5569 -0.3639 0.8175 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8742 -0.1623 -0.4645 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5754 -0.1594 -0.5968 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6471 -0.3517 0.4895 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3543 -0.3397 0.3016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7044 -0.1373 -0.9839 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8488 -1.3313 -1.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7974 -1.5560 -0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8355 -0.4091 -0.1328 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1539 -0.8777 0.9411 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1697 0.2024 1.2329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1057 -0.3212 2.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8549 -1.5510 1.9136 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7173 -1.3600 0.7223 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3485 -2.3422 0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8906 -0.1527 0.1003 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7053 0.0465 -1.0389 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7314 0.4979 -2.1404 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4158 0.7549 -3.4208 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0685 1.8163 -3.5656 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3672 -0.1403 -4.4859 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.6952 1.1219 -0.7607 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6012 0.8885 0.3137 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.3854 -0.3032 0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0213 0.7565 1.6123 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5211 2.0399 0.3305 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2599 1.6638 0.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7965 -0.0077 -0.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9183 1.4220 -0.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9607 0.6085 2.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8005 1.7527 1.2882 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9597 -0.6507 1.6683 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3033 -1.2083 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5186 -0.0082 -1.3362 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2211 0.0035 -1.6285 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0671 -0.5094 1.4945 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7236 -0.4953 1.1978 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3459 0.1264 -1.8226 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9734 0.7233 -0.8897 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5236 -2.2082 -1.3536 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -1.2034 -2.3795 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1646 -2.4359 -0.5918 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2371 -1.7742 0.6716 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3955 0.4718 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3269 -0.0912 -1.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4373 -1.0531 1.8511 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -1.7510 0.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6868 0.4991 0.3202 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6396 1.1297 1.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8616 0.4951 2.4933 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5692 -0.4485 3.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5018 -1.8080 2.8081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1827 -2.4060 1.6792 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1547 -0.9200 -1.2993 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9751 -0.3022 -2.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2862 1.4357 -1.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3115 1.2617 -1.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1998 2.1115 -0.5597 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3252 -0.2102 0.6032 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8221 -1.1843 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6628 -0.3403 -1.0397 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6745 1.3163 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0984 -0.3095 1.9702 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0048 1.1399 1.6993 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9834 2.9116 0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6877 2.3223 -0.7261 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4286 1.7881 0.8770 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 2 3 5 6 1 0 6 7 2 3 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 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 19 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 25 28 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 5 37 1 0 6 38 1 0 7 39 1 0 8 40 1 0 8 41 1 0 9 42 1 0 9 43 1 0 10 44 1 0 10 45 1 0 11 46 1 0 11 47 1 0 12 48 1 0 12 49 1 0 13 50 1 0 13 51 1 0 14 52 1 0 14 53 1 0 15 54 1 0 15 55 1 0 19 56 1 0 20 57 1 0 20 58 1 0 24 59 1 0 24 60 1 0 26 61 1 0 26 62 1 0 26 63 1 0 27 64 1 0 27 65 1 0 27 66 1 0 28 67 1 0 28 68 1 0 28 69 1 0 M CHG 2 23 -1 25 1 M END