HMDB0240776 RDKit 3D O-(13-Carboxytridecanoyl)carnitine 67 66 0 0 0 0 0 0 0 0999 V2000 -7.3683 -1.6728 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1046 -1.1663 -0.1676 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.6077 -2.2967 0.6228 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4773 -0.1158 0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2283 -0.8500 -1.2406 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4442 0.4098 -1.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1485 1.6832 -1.4214 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 1.7104 -2.8049 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5346 0.7973 -3.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4233 2.8278 -3.2351 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.6553 0.3779 0.0188 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2936 0.2773 0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6503 0.2055 -1.0023 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6026 0.2550 1.3665 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0899 0.1448 1.1902 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5007 0.1285 2.5723 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9992 0.0211 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6228 1.2114 1.8741 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1214 1.0362 1.9459 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7975 2.1868 1.2659 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3962 2.2876 -0.1724 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7418 1.0183 -0.9032 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2282 0.7692 -0.8204 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6367 -0.4872 -1.5638 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9715 -1.7312 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4421 -2.8936 -1.8135 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9555 -3.1127 -2.9392 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4161 -3.7315 -1.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8564 -2.3530 -0.0265 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1984 -2.2141 -1.6787 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0756 -0.8408 -0.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8842 -1.8647 1.3495 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4277 -2.7579 1.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1631 -3.0753 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8706 -0.6396 1.6566 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3771 0.3987 0.3115 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6892 0.5321 1.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7815 -0.9544 -2.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4765 -1.7068 -1.2893 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6581 0.3279 -1.9926 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9803 1.9517 -0.7642 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 2.4938 -1.3727 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8996 -0.6427 1.9614 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7893 1.1728 1.9648 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 1.0129 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1797 -0.8069 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2531 1.0993 3.0953 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1094 -0.7348 3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 0.0971 3.6644 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3845 -0.9011 2.1643 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2867 1.2258 0.8112 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3465 2.1747 2.3224 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4517 0.0771 1.4851 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4242 0.9686 3.0238 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4385 3.1421 1.7733 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9013 2.1129 1.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3061 2.5325 -0.2787 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9853 3.1421 -0.6547 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2111 0.1432 -0.4886 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4511 1.1604 -1.9961 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7583 1.6379 -1.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4899 0.5889 0.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2868 -0.3267 -2.6252 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7271 -0.5567 -1.5762 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2597 -1.8850 0.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8677 -1.6428 -1.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2489 -3.3800 -0.8094 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 2 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 6 11 1 0 11 12 1 0 12 13 2 0 12 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 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 7 41 1 0 7 42 1 0 14 43 1 0 14 44 1 0 15 45 1 0 15 46 1 0 16 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 18 51 1 0 18 52 1 0 19 53 1 0 19 54 1 0 20 55 1 0 20 56 1 0 21 57 1 0 21 58 1 0 22 59 1 0 22 60 1 0 23 61 1 0 23 62 1 0 24 63 1 0 24 64 1 0 25 65 1 0 25 66 1 0 28 67 1 0 M CHG 2 2 1 10 -1 M END