HMDB0240861 RDKit 3D 13-MethylHexadecanoylcarnitine 76 75 0 0 0 0 0 0 0 0999 V2000 8.6160 1.8906 2.9526 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5932 1.0430 2.1852 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0123 0.9670 0.7291 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 0.1535 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5492 0.1350 -1.5161 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7631 -1.1931 0.4684 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8347 -2.0282 -0.3331 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4738 -1.4176 -0.5469 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7356 -1.1449 0.7107 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3946 -0.5250 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -1.4077 -0.4372 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1612 -0.8211 -0.7303 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2848 0.4684 -1.4727 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0752 1.0640 -1.7736 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8704 0.1030 -2.6202 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2087 0.7234 -2.9186 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9357 0.9946 -1.6649 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 2.0843 -1.0102 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 0.0917 -1.0993 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5378 0.3305 0.1078 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -0.6285 1.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -2.0465 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6638 -2.3652 -0.3293 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7401 -3.0757 1.6097 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.9961 0.2577 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8609 0.4800 0.9560 N 0 0 0 0 0 4 0 0 0 0 0 0 -9.1505 0.9113 0.3839 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1822 -0.7436 1.6891 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4465 1.5065 1.8594 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1627 2.2453 3.9193 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7825 2.8022 2.3427 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5357 1.3118 3.1289 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6235 0.0407 2.6804 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5947 1.4847 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9747 2.0166 0.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0494 0.6206 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0925 0.7366 -0.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1338 -0.7632 -1.7885 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6954 0.2972 -2.2382 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2170 1.0076 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7245 -1.7416 0.5594 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3942 -1.0652 1.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6649 -2.9784 0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3009 -2.3244 -1.2798 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8681 -2.1611 -1.1466 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5023 -0.5015 -1.1651 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3104 -0.3841 1.2978 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5387 -2.0464 1.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8197 -0.3125 1.3417 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5102 0.4534 -0.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9945 -1.5552 -1.4496 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4173 -2.4273 -0.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4059 -0.7075 0.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3978 -1.5945 -1.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7963 1.2214 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7976 0.3234 -2.4323 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6307 1.2876 -0.8393 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9815 1.9996 -2.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0908 -0.8637 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3724 -0.0745 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 0.1386 -3.6489 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0146 1.7119 -3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2047 1.3485 0.4276 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3462 -0.4269 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8922 -0.4349 1.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2445 1.0413 -0.9411 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2497 -0.7250 -0.6066 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3879 0.1322 -0.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9348 0.9732 1.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9770 1.8563 -0.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6619 -0.7463 2.6703 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9988 -1.6241 1.0697 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2741 -0.7866 1.9592 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1226 1.0284 2.8245 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3346 2.1366 2.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7178 2.2219 1.4652 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 4 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 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 20 25 1 0 25 26 1 0 26 27 1 0 26 28 1 0 26 29 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 6 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 20 63 1 0 21 64 1 0 21 65 1 0 25 66 1 0 25 67 1 0 27 68 1 0 27 69 1 0 27 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 M CHG 2 24 -1 26 1 M END