HMDB0241770 RDKit 3D 3-Hydroxynona-5,7-dienoylcarnitine 49 48 0 0 0 0 0 0 0 0999 V2000 7.9288 -0.2492 0.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9324 0.4222 -0.4268 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6565 0.0111 -0.5171 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7276 0.7023 -1.3678 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4865 0.3515 -1.4952 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9017 -0.7902 -0.7848 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7723 -0.3496 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2471 -1.4605 0.7948 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 0.3004 -0.7367 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4421 0.7491 0.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4687 1.9523 0.4614 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4016 -0.1984 0.4864 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4726 0.2097 1.2795 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3501 -0.4123 2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3416 -1.8819 2.6432 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4083 -2.5152 2.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1418 -2.5580 2.6880 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.8274 -0.1182 0.7757 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1899 0.4116 -0.4944 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.6943 -0.4122 -1.5987 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6574 0.3276 -0.5788 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8197 1.7625 -0.7527 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7383 -0.6534 -0.1925 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3762 -1.0580 0.9794 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2802 0.4877 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2653 1.2771 -0.9963 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4026 -0.8295 0.0711 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0895 1.5700 -1.9367 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8546 0.9475 -2.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3567 -1.3821 -1.5958 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6246 -1.4225 -0.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2033 0.3155 0.8862 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9111 -2.1370 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3684 -0.4302 -1.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1404 1.2146 -1.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4323 1.3214 1.4945 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1871 -0.0186 3.3225 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4163 -0.0793 3.1798 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5623 0.2768 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0342 -1.2156 0.7398 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6858 -0.0669 -1.9128 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7019 -1.4948 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3708 -0.2751 -2.4561 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0473 1.0974 0.1025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0097 0.4805 -1.6247 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9827 -0.6552 -0.1615 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7805 1.9125 -1.0836 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4457 2.1109 -1.6283 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1027 2.4516 0.0783 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 3 3 4 1 0 4 5 2 3 5 6 1 0 6 7 1 0 7 8 1 0 7 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 3 27 1 0 4 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 8 33 1 0 9 34 1 0 9 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 18 39 1 0 18 40 1 0 20 41 1 0 20 42 1 0 20 43 1 0 21 44 1 0 21 45 1 0 21 46 1 0 22 47 1 0 22 48 1 0 22 49 1 0 M CHG 2 17 -1 19 1 M END