HMDB0241838 RDKit 3D 13-(3,4-Dimethyl-5-propylfuran-2-yl)tridecanoylcarnitine 86 86 0 0 0 0 0 0 0 0999 V2000 10.6234 1.8747 0.7311 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3943 0.6188 0.3224 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7481 -0.0023 -0.8942 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3380 -0.3543 -0.5057 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2455 0.2850 -0.7749 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1834 -0.2801 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7475 0.1325 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9785 -0.6731 -1.3659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5536 -0.1994 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8203 -0.3464 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4032 0.2046 -0.3121 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5973 0.0915 0.9317 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8154 0.6544 0.6798 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6666 2.0809 0.2867 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8766 2.9126 0.1505 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9429 2.5292 -0.7894 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7043 1.3076 -0.4641 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8065 1.0516 -1.5321 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -0.2060 -1.0585 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9951 -1.3360 -1.2905 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6705 -0.1317 -0.3657 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4106 -1.2279 0.1407 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5400 -1.1149 1.6061 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2435 -1.0993 2.3156 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2505 -1.0511 3.6053 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0014 -1.1311 1.7480 O 0 0 0 0 0 1 0 0 0 0 0 0 -8.7103 -1.4162 -0.5887 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6183 -0.3382 -0.5484 N 0 0 0 0 0 4 0 0 0 0 0 0 -10.3881 -0.2865 0.6825 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0390 0.9551 -0.8447 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5964 -0.5704 -1.6304 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6149 -1.4060 0.3633 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7546 -2.3905 1.0864 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0061 -1.4637 0.2308 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8122 -2.5507 0.8091 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6403 1.5993 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4295 2.5025 -0.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1824 2.4114 1.5215 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2693 -0.0792 1.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4665 0.8245 0.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3065 -0.9574 -1.0833 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7952 0.6359 -1.7899 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6794 1.2045 -0.7054 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2757 0.1155 0.6299 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4209 -0.4994 -2.3665 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0513 -1.7686 -1.1831 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9636 -0.6913 -2.2008 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6022 0.9010 -1.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3004 0.1094 0.7588 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -1.4285 0.1108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5749 1.2741 -0.5717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9376 -0.3881 -1.1152 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0168 0.5855 1.8085 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4348 -0.9802 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4895 0.5129 1.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1212 0.0762 -0.2456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1208 2.5993 0.9201 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1645 2.1374 -0.7505 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3061 2.9853 1.2263 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5716 4.0046 -0.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6709 3.4020 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5053 2.4759 -1.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2071 0.3659 -0.3256 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 1.5323 0.5035 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4879 1.9027 -1.5499 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3298 0.9050 -2.4989 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8183 -2.1355 -0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0968 -0.2290 1.9648 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1076 -1.9931 2.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2046 -2.3125 -0.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4692 -1.6902 -1.6379 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2478 -1.1801 1.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1962 0.6659 1.2401 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4980 -0.2455 0.4813 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8227 1.6992 -1.1345 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3159 0.9361 -1.6576 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5809 1.3643 0.0832 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1326 -1.5193 -1.4192 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2903 0.2984 -1.6102 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0124 -0.6274 -2.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4306 -3.1513 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3043 -2.8747 1.9165 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8879 -1.8596 1.5409 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6344 -3.5184 0.2759 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8922 -2.3536 0.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5456 -2.6666 1.8977 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 1 0 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 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 22 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 28 31 1 0 6 32 2 0 32 33 1 0 32 34 1 0 34 35 1 0 34 4 2 0 1 36 1 0 1 37 1 0 1 38 1 0 2 39 1 0 2 40 1 0 3 41 1 0 3 42 1 0 7 43 1 0 7 44 1 0 8 45 1 0 8 46 1 0 9 47 1 0 9 48 1 0 10 49 1 0 10 50 1 0 11 51 1 0 11 52 1 0 12 53 1 0 12 54 1 0 13 55 1 0 13 56 1 0 14 57 1 0 14 58 1 0 15 59 1 0 15 60 1 0 16 61 1 0 16 62 1 0 17 63 1 0 17 64 1 0 18 65 1 0 18 66 1 0 22 67 1 0 23 68 1 0 23 69 1 0 27 70 1 0 27 71 1 0 29 72 1 0 29 73 1 0 29 74 1 0 30 75 1 0 30 76 1 0 30 77 1 0 31 78 1 0 31 79 1 0 31 80 1 0 33 81 1 0 33 82 1 0 33 83 1 0 35 84 1 0 35 85 1 0 35 86 1 0 M CHG 2 26 -1 28 1 M END