HMDB0240585 RDKit 3D cis-4-Decenoylcarnitine 54 53 0 0 0 0 0 0 0 0999 V2000 -7.2698 -1.5915 0.6031 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6731 -0.1286 0.5122 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 0.5704 -0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3025 0.3566 0.5959 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1027 1.0328 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8835 0.4503 -1.3767 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7961 -0.1830 -1.7735 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6311 -0.3914 -0.9044 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 0.2491 -1.4803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7372 -0.0269 -0.5165 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5634 -0.6740 0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0075 0.4387 -0.7798 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1211 0.2117 0.1075 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6784 1.5778 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7058 2.4837 1.0767 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5348 2.1214 1.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0409 3.7871 1.4401 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0904 -0.6076 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2964 -0.9914 -0.0665 N 0 0 0 0 0 4 0 0 0 0 0 0 6.3635 -0.1615 -0.6617 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6944 -2.3658 -0.4226 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3936 -0.8561 1.3406 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -1.8594 -0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8789 -1.7847 1.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2242 -2.1788 0.5261 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5932 0.0098 -0.0663 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7379 0.3444 1.5005 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7257 1.6468 -0.3204 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4016 0.0582 -1.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4253 0.7749 1.6119 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0623 -0.7154 0.7261 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2893 0.9772 0.6692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3576 2.1395 -0.1864 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7181 0.5797 -2.0915 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7753 -0.5739 -2.8238 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7819 0.0606 0.0693 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3943 -1.4981 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1436 -0.1230 -2.4952 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.3300 -1.5408 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -0.3319 0.9564 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9266 2.0804 -0.5555 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5592 1.5553 1.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3361 4.4829 0.7699 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5505 -1.5418 -1.0121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2643 -0.0569 -1.6647 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9816 0.8654 -0.7097 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4474 -0.5255 -1.7163 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3046 -0.2743 -0.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2582 -3.0545 0.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3465 -2.6394 -1.4226 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7939 -2.4279 -0.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1823 -0.1061 1.6406 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4564 -0.6978 1.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8064 -1.8173 1.7682 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 2 0 7 8 1 0 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 5 33 1 0 6 34 1 0 7 35 1 0 8 36 1 0 8 37 1 0 9 38 1 0 9 39 1 0 13 40 1 1 14 41 1 0 14 42 1 0 17 43 1 0 18 44 1 0 18 45 1 0 20 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 21 50 1 0 21 51 1 0 22 52 1 0 22 53 1 0 22 54 1 0 M CHG 1 19 1 M END