HMDB0241333 RDKit 3D 6-Hydroxytrideca-8,10-dienoylcarnitine 61 60 0 0 0 0 0 0 0 0999 V2000 10.0937 0.0415 0.8155 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4968 -0.6327 -0.4051 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2556 0.0952 -0.7557 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1139 -0.5647 -0.7556 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8969 0.1467 -1.0984 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7521 -0.4990 -1.1004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5039 0.2151 -1.4476 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5625 0.1446 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1494 0.7273 0.8387 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0901 -1.2614 -0.0613 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1602 -1.3919 1.1136 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0729 -0.5494 0.9835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8539 -0.9866 -0.2268 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0889 -0.1619 -0.3891 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9031 1.0886 -0.4704 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3711 -0.6822 -0.4488 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4889 0.2135 -0.6057 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 -0.2505 -1.7671 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5066 -0.2693 -3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3072 0.0776 -3.0079 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1086 -0.6677 -4.2412 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.2281 0.1035 0.7104 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3848 0.9079 0.8498 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.5896 0.2696 0.3432 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6005 1.0464 2.3052 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2712 2.2369 0.3249 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9034 -0.5471 1.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2176 0.0935 0.7288 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7155 1.0619 0.8915 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3006 -1.6822 -0.1352 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1937 -0.5531 -1.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2887 1.1386 -1.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0778 -1.6128 -0.5074 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9234 1.1895 -1.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7073 -1.5360 -0.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0198 -0.2613 -2.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6955 1.2787 -1.7121 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6763 0.8090 -0.5046 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3318 0.1082 1.5809 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -1.6227 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9971 -1.8955 0.1417 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7066 -1.0397 2.0225 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9182 -2.4687 1.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1965 0.5128 0.8518 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6861 -0.6521 1.9037 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2481 -0.9566 -1.1316 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -2.0318 -0.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0792 1.2104 -0.7179 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1202 0.4797 -1.9568 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7062 -1.2683 -1.6455 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5008 -0.9469 0.9215 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4831 0.3904 1.4964 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4089 0.2403 1.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3936 -0.7833 0.0516 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0086 0.8571 -0.5178 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8380 1.7651 2.6936 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3476 0.0649 2.7509 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6067 1.4157 2.5335 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2483 2.6058 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8917 2.2925 -0.6062 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7963 2.9468 1.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 2 3 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 17 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 2 31 1 0 3 32 1 0 4 33 1 0 5 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 8 38 1 0 9 39 1 0 10 40 1 0 10 41 1 0 11 42 1 0 11 43 1 0 12 44 1 0 12 45 1 0 13 46 1 0 13 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 22 51 1 0 22 52 1 0 24 53 1 0 24 54 1 0 24 55 1 0 25 56 1 0 25 57 1 0 25 58 1 0 26 59 1 0 26 60 1 0 26 61 1 0 M CHG 2 21 -1 23 1 M END