HMDB0240853 RDKit 3D 14-Methylpentadecanoylcarnitine 73 72 0 0 0 0 0 0 0 0999 V2000 7.0287 3.2116 -1.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5229 2.1571 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0797 1.0440 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 1.8740 0.5139 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5489 0.9034 1.6093 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8359 -0.5134 1.2731 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7573 -1.2032 0.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4211 -1.2125 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4158 -1.9410 0.3739 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0321 -1.9776 1.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0937 -2.7301 0.1354 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3057 -2.8396 0.6087 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 -1.5552 0.7888 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1439 -0.7628 -0.4993 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9382 0.5291 -0.3073 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3094 0.2274 0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5717 0.3228 1.3666 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3672 -0.1647 -0.6291 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6465 -0.4580 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7023 -2.0085 -0.3144 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9711 -2.5730 0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 -2.4409 1.2331 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7194 -3.3278 -0.8294 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.8102 0.1471 -0.8612 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8689 1.5869 -0.8588 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.2626 2.2028 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2551 2.0641 -0.9073 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2666 2.1088 -2.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4137 3.9721 -0.9105 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4926 2.6786 -2.2135 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9203 3.6873 -1.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 2.7193 0.1849 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3978 1.4305 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3858 0.2329 -1.4234 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0488 0.6787 -0.7661 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1072 2.8670 1.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4728 1.6601 -0.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3871 1.2430 2.2917 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6048 0.9194 2.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8097 -0.5946 0.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9078 -1.0791 2.2389 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0659 -2.2356 0.2908 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5207 -0.7275 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5747 -1.8195 2.1412 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0891 -0.2223 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3568 -1.4532 -0.6238 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7138 -2.9931 0.1941 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0855 -2.3594 2.0494 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6835 -0.9202 1.0803 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1393 -2.3185 -0.8864 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4945 -3.7883 0.0685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -3.4271 -0.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4252 -3.4314 1.5389 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6079 -0.9373 1.6058 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0806 -1.8087 1.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1101 -0.4456 -0.7553 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5387 -1.3841 -1.3035 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0309 0.9936 -1.3281 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4044 1.1715 0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7113 -0.2984 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8792 -2.4399 0.3192 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4668 -2.3236 -1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7276 -0.1971 -0.3099 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -0.2636 -1.9025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7686 3.2020 0.4279 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1897 2.4533 0.1763 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4549 1.6338 1.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9296 1.4674 -0.2656 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2248 3.1172 -0.5732 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5979 2.1023 -1.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 2.9999 -2.4537 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1966 2.2866 -1.9479 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4551 1.2807 -2.8473 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 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 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 19 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 25 28 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 6 40 1 0 6 41 1 0 7 42 1 0 7 43 1 0 8 44 1 0 8 45 1 0 9 46 1 0 9 47 1 0 10 48 1 0 10 49 1 0 11 50 1 0 11 51 1 0 12 52 1 0 12 53 1 0 13 54 1 0 13 55 1 0 14 56 1 0 14 57 1 0 15 58 1 0 15 59 1 0 19 60 1 0 20 61 1 0 20 62 1 0 24 63 1 0 24 64 1 0 26 65 1 0 26 66 1 0 26 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 M CHG 2 23 -1 25 1 M END