HMDB0241788 RDKit 3D 6-Oxononanoylcarnitine 51 50 0 0 0 0 0 0 0 0999 V2000 7.5202 0.8228 1.0563 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4435 0.2015 0.2167 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1043 0.7730 0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0883 0.0878 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2842 0.1099 -1.4485 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.5814 0.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9922 -1.2167 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3281 -0.2441 -1.5921 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4607 0.6882 -0.7586 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5723 -0.0605 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -0.3975 1.1644 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7587 -0.3795 -0.5989 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8158 -1.0759 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0655 -2.4343 -0.7275 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9318 -3.3287 -0.7017 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9027 -3.0407 -1.3341 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9506 -4.5037 0.0107 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.0918 -0.3255 -0.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2241 0.9694 0.2999 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.6040 1.0019 1.7055 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1632 1.9042 0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3966 1.5669 -0.3955 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3465 0.0630 1.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9007 1.7814 0.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0992 0.9996 2.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 0.4566 -0.8395 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4044 -0.8926 0.4073 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0762 1.8648 0.3797 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9042 0.6217 1.6901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2813 -1.3976 0.9991 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3841 0.1430 0.9911 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5583 -1.9339 -1.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1553 -1.7743 -0.1543 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1162 0.3501 -2.0888 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7546 -0.7231 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0527 1.2919 -0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0007 1.4234 -1.4771 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6556 -1.3532 1.0274 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4222 -2.1567 -1.7311 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9064 -2.8759 -0.1166 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9849 -0.9177 0.1537 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3232 -0.2561 -1.3376 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0687 2.0095 1.8864 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6928 0.9223 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3755 0.2439 1.9006 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5565 2.9704 0.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 1.7427 -0.8698 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4829 1.8448 0.9421 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9927 1.8238 -1.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1227 0.7515 -0.5517 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7711 2.4396 0.1242 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 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 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 2 27 1 0 3 28 1 0 3 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 13 38 1 0 14 39 1 0 14 40 1 0 18 41 1 0 18 42 1 0 20 43 1 0 20 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 21 48 1 0 22 49 1 0 22 50 1 0 22 51 1 0 M CHG 2 17 -1 19 1 M END