HMDB0241046 RDKit 3D 3-methylheptanedioylcarnitine 49 48 0 0 0 0 0 0 0 0999 V2000 2.6927 -0.6646 1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6799 0.4067 0.8177 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0365 0.6895 0.2122 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6388 -0.4884 -0.4593 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9763 -0.1438 -1.0402 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9628 0.2572 -0.0156 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7179 0.2227 1.2114 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2415 0.7018 -0.3881 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6624 0.0557 -0.2532 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3026 -0.0675 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1366 0.1077 1.5275 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7833 -0.3663 -0.4356 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1295 -0.4961 0.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4083 -1.9522 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7057 -2.4600 0.3428 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -2.6596 -0.4421 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9513 -2.7463 1.6979 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.9890 0.5009 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3288 0.7008 -0.2433 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.2594 0.3013 -1.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8463 0.3305 1.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 2.1900 -0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5364 -0.2376 2.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6428 -1.2226 1.9147 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8962 -1.4260 1.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.3516 1.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8664 1.4724 -0.5583 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6813 1.1013 0.9836 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8378 -1.3405 0.2568 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9817 -0.8880 -1.2673 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9031 0.6426 -1.8317 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3544 -1.0803 -1.5399 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4465 1.6913 -0.5011 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6474 0.8630 -1.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8969 -0.9212 -0.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9963 -0.2994 1.1602 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1812 -2.2920 -1.1545 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6509 -2.5740 0.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9628 0.2927 -1.6717 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4436 1.4941 -0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5424 1.1539 -1.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2052 -0.1019 -0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7579 -0.4141 -2.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1401 -0.0183 1.7779 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6358 -0.4386 0.9081 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4035 1.1716 1.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3071 2.5175 -1.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7453 2.6399 0.4113 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5422 2.4422 0.0376 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 6 8 1 0 2 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 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 5 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