HMDB0241098 RDKit 3D (3,5)-Decadienoylcarnitine 51 50 0 0 0 0 0 0 0 0999 V2000 7.9155 1.4896 -0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5652 0.7666 -0.2569 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7317 -0.7073 -0.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4367 -1.4324 -0.4926 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9425 -1.0571 -1.8079 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -0.5417 -2.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7997 -0.2942 -0.9937 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9988 -0.0801 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 0.4709 -0.2118 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4843 -0.3720 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5062 -1.5877 0.3781 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 0.2687 0.4056 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9657 -0.2232 0.7416 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2241 -0.2202 2.2156 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1426 1.0496 2.9162 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8696 2.1932 2.4375 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 1.0314 4.2962 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.9345 0.3125 -0.2027 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3097 0.1043 -0.1357 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.8378 0.4707 -1.4674 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8876 1.1317 0.7761 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9178 -1.1174 0.2548 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 1.3100 0.9508 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5855 1.0008 -0.8568 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6929 2.5352 -0.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0727 1.0815 -1.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8881 1.0526 0.5779 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1915 -1.0021 0.7473 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4233 -1.0456 -1.0568 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6583 -1.2395 0.2492 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6111 -2.5547 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5778 -1.1823 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5721 -0.3381 -3.1211 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 0.4482 -1.9114 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2824 -0.3159 0.9618 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4232 0.6725 -1.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 1.4756 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -1.3376 0.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5069 -0.9466 2.7035 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2238 -0.6197 2.3621 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7345 1.4005 -0.3352 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5796 -0.0866 -1.2293 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1458 1.1887 -1.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9717 -0.4593 -2.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8042 0.9549 -1.3556 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2082 0.6774 1.6921 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7515 1.6534 0.2924 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1731 1.9572 0.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4129 -2.0766 -0.0263 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9147 -1.2086 -0.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2489 -1.1319 1.3030 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 2 3 6 7 1 0 7 8 2 3 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 13 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 19 22 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 6 33 1 0 7 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 18 41 1 0 18 42 1 0 20 43 1 0 20 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 21 48 1 0 22 49 1 0 22 50 1 0 22 51 1 0 M CHG 2 17 -1 19 1 M END