HMDB0240872 RDKit 3D 15-Methylheptadecanoylcarnitine 79 78 0 0 0 0 0 0 0 0999 V2000 7.8326 0.8908 3.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9231 1.8721 2.0377 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4658 1.3742 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8610 0.8193 0.8471 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5721 0.4957 -0.0629 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1258 -0.7692 0.5724 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -1.5234 -0.4341 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0226 -0.7485 -0.8234 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2308 -1.5743 -1.8237 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9822 -0.8543 -2.2575 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0365 -0.5691 -1.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7964 0.1607 -1.5257 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0609 -0.5148 -2.5369 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5879 -1.8439 -2.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4041 -2.1309 -1.0481 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6699 -1.4155 -0.8742 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5843 0.0584 -0.6254 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9996 0.5291 -0.4804 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5483 1.1345 -1.4456 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7864 0.3657 0.6243 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1110 0.8485 0.6712 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 1.8256 1.8244 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1752 2.9205 1.5859 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9349 2.7477 1.4274 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6496 4.2228 1.5306 O 0 0 0 0 0 1 0 0 0 0 0 0 -7.0915 -0.2774 0.8258 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4626 0.0858 0.8756 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.8644 1.1442 -0.0312 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2051 -1.1007 0.3916 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9564 0.3156 2.2205 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2581 -0.1161 2.9291 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2849 1.2982 4.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 0.7341 3.4126 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8953 2.3065 1.8679 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5001 2.7700 2.4187 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5954 2.3170 0.1033 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4120 0.9047 -0.1113 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7932 -0.2785 1.0599 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4605 1.2832 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1194 0.2285 -0.9944 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6736 1.0969 -0.3285 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4814 -0.6161 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9283 -1.4547 0.8451 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8999 -1.6848 -1.3407 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 -2.5214 -0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2259 0.2108 -1.3342 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4008 -0.5539 0.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9617 -2.5622 -1.4194 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8691 -1.7242 -2.7096 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3194 0.0754 -2.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5148 -1.4961 -3.0458 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5787 0.0885 -0.3986 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7418 -1.5055 -0.6056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 1.1537 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2604 0.4750 -0.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 0.2112 -3.0298 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6859 -0.7051 -3.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2411 -2.1336 -3.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2684 -2.5907 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8233 -2.0396 -0.0743 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6719 -3.2451 -1.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3018 -1.6216 -1.8082 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3261 -1.8999 -0.0745 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0475 0.1600 0.3698 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0298 0.6596 -1.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3107 1.3725 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1333 2.2786 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7729 1.3141 2.7459 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9586 -0.9048 -0.1057 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8607 -0.8670 1.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9098 0.9510 -0.4212 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2214 1.1372 -0.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9632 2.1358 0.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2809 -1.0383 -0.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7142 -2.0365 0.6722 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2318 -1.0952 0.7517 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4475 1.3040 2.3305 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1139 0.1634 2.9452 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7216 -0.4280 2.5218 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 3 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 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 21 26 1 0 26 27 1 0 27 28 1 0 27 29 1 0 27 30 1 0 1 31 1 0 1 32 1 0 1 33 1 0 2 34 1 0 2 35 1 0 3 36 1 0 4 37 1 0 4 38 1 0 4 39 1 0 5 40 1 0 5 41 1 0 6 42 1 0 6 43 1 0 7 44 1 0 7 45 1 0 8 46 1 0 8 47 1 0 9 48 1 0 9 49 1 0 10 50 1 0 10 51 1 0 11 52 1 0 11 53 1 0 12 54 1 0 12 55 1 0 13 56 1 0 13 57 1 0 14 58 1 0 14 59 1 0 15 60 1 0 15 61 1 0 16 62 1 0 16 63 1 0 17 64 1 0 17 65 1 0 21 66 1 0 22 67 1 0 22 68 1 0 26 69 1 0 26 70 1 0 28 71 1 0 28 72 1 0 28 73 1 0 29 74 1 0 29 75 1 0 29 76 1 0 30 77 1 0 30 78 1 0 30 79 1 0 M CHG 2 25 -1 27 1 M END