HMDB0240973 RDKit 3D 11-Methyltricosanoylcarnitine 97 96 0 0 0 0 0 0 0 0999 V2000 7.9255 -4.0409 -2.6231 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1270 -3.7597 -1.1341 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1820 -2.7175 -0.9453 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4222 -2.4033 0.4943 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2065 -1.8819 1.2232 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6945 -0.5988 0.5724 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -0.1577 1.3744 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9007 1.0931 0.8227 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3987 0.9368 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -0.1250 -0.7063 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1153 0.1515 0.1592 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 1.4026 -0.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2179 1.8001 0.5672 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1844 0.7629 0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8907 3.1933 0.1096 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2425 3.8945 0.7045 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6352 3.4169 0.5201 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1079 3.4037 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5017 2.9352 -1.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6264 3.6537 -0.4977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9404 3.9773 0.8554 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2738 3.0729 1.9476 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4505 1.9623 2.4144 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3768 0.8216 1.4724 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3156 0.2219 1.1605 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5591 0.3596 0.8824 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4625 -0.8034 -0.0521 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0422 -0.2251 -1.3034 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0431 -1.0146 -2.5165 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3242 -2.0174 -2.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8668 -0.6909 -3.6075 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.3525 -1.7912 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5888 -3.0844 0.1929 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.6873 -3.1586 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5181 -3.8923 -0.2694 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1572 -3.8636 1.3611 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9463 -4.1663 -3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3277 -4.9497 -2.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3796 -3.1799 -3.0683 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1413 -3.3504 -0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3448 -4.6891 -0.5747 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1324 -3.1092 -1.3627 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9158 -1.8000 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2099 -1.6058 0.6037 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7290 -3.3345 1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5069 -1.6461 2.2519 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4396 -2.6637 1.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4799 0.1829 0.5921 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4351 -0.8234 -0.4686 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7583 -0.9998 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7397 0.0004 2.4403 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1457 1.5401 1.4924 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7314 1.8536 0.7667 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9886 1.8940 -0.9583 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2483 0.6014 -1.2381 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0096 -0.1339 -1.7791 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7315 -1.1415 -0.5034 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -0.7608 0.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5349 0.2558 1.2063 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0976 1.3049 -1.3019 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1739 2.2585 -0.2698 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5779 1.8881 1.6397 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4591 0.9451 -0.4311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3975 0.5859 1.3923 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6971 -0.2459 0.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9213 3.2589 -1.0185 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8236 3.7982 0.3852 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2265 5.0108 0.5059 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0739 3.8814 1.8396 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7473 2.3884 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2691 4.0295 1.2131 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9289 4.3993 -1.3996 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4544 2.7219 -1.4721 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6866 2.9852 -2.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5014 1.8339 -0.9367 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5705 3.1053 -0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7671 4.6390 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 4.6420 0.7848 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 4.8205 1.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4476 3.7636 2.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3840 2.7120 1.8388 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8172 1.5119 3.3846 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3991 2.2807 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4273 -1.0354 -0.1122 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1104 0.1129 -1.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5312 0.7769 -1.4395 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0043 -1.8464 1.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3566 -1.2542 0.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3366 -3.5312 -1.7492 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5282 -3.8093 -0.4099 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1050 -2.1447 -0.8945 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2982 -4.6923 0.4586 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7415 -4.4247 -1.2272 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5384 -3.3326 -0.3605 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8806 -4.5951 1.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3314 -4.4003 1.8711 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5848 -3.1510 2.0861 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 13 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 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 27 32 1 0 32 33 1 0 33 34 1 0 33 35 1 0 33 36 1 0 1 37 1 0 1 38 1 0 1 39 1 0 2 40 1 0 2 41 1 0 3 42 1 0 3 43 1 0 4 44 1 0 4 45 1 0 5 46 1 0 5 47 1 0 6 48 1 0 6 49 1 0 7 50 1 0 7 51 1 0 8 52 1 0 8 53 1 0 9 54 1 0 9 55 1 0 10 56 1 0 10 57 1 0 11 58 1 0 11 59 1 0 12 60 1 0 12 61 1 0 13 62 1 0 14 63 1 0 14 64 1 0 14 65 1 0 15 66 1 0 15 67 1 0 16 68 1 0 16 69 1 0 17 70 1 0 17 71 1 0 18 72 1 0 18 73 1 0 19 74 1 0 19 75 1 0 20 76 1 0 20 77 1 0 21 78 1 0 21 79 1 0 22 80 1 0 22 81 1 0 23 82 1 0 23 83 1 0 27 84 1 0 28 85 1 0 28 86 1 0 32 87 1 0 32 88 1 0 34 89 1 0 34 90 1 0 34 91 1 0 35 92 1 0 35 93 1 0 35 94 1 0 36 95 1 0 36 96 1 0 36 97 1 0 M CHG 2 31 -1 33 1 M END