HMDB0013330 RDKit 3D 3-Hydroxy-cis-5-tetradecenoylcarnitine 66 65 0 0 0 0 0 0 0 0999 V2000 8.4613 -0.3093 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6719 0.8972 -0.0937 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5191 1.6980 -0.5431 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5389 1.0127 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7816 -0.1301 -0.8377 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9686 0.3943 0.3283 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1787 -0.6681 1.0099 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1774 -1.3682 0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2421 -0.3516 -0.3804 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9437 -0.3166 -0.2025 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2275 -1.3676 0.5634 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4386 -0.6974 1.7341 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4877 -0.0598 2.5571 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5669 0.1780 1.2993 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6146 -0.6271 0.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6047 -1.8800 0.5352 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7295 -0.0268 0.0379 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7487 -0.7802 -0.6096 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8951 -0.4401 -2.0441 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9274 -1.2393 -2.7429 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4212 -0.8793 -3.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3928 -2.4255 -2.2054 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.0283 -0.6509 0.1519 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5698 0.6372 0.3347 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.6822 1.7341 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3470 0.5742 1.5996 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5604 0.9828 -0.6885 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3234 -0.4444 1.4836 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5835 -1.2508 0.1137 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5759 -0.3565 1.3584 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3096 0.6674 -1.0106 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3842 1.5646 0.5011 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0313 2.2373 0.3175 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9499 2.5487 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 0.6487 -2.3155 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7723 1.7725 -1.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0937 -0.5026 -1.6499 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3588 -0.9946 -0.5348 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3165 1.2177 -0.0717 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6455 0.8736 1.0421 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8979 -1.4655 1.3336 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6447 -0.2366 1.8623 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7541 -2.1814 0.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7312 -1.8042 -0.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6508 0.4866 -0.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3083 0.4853 -0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8379 -2.2265 0.8526 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5189 -1.7849 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9031 -1.4945 2.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4611 -0.3492 3.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0174 0.7100 2.1967 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1844 0.9919 0.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4518 -1.8460 -0.5368 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1996 0.6307 -2.2395 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9468 -0.6016 -2.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8359 -1.1597 1.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7921 -1.2971 -0.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3341 2.6604 0.5315 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9544 1.9276 -0.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2189 1.7311 1.5368 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5996 0.7484 2.4004 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7776 -0.4578 1.6905 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1084 1.3566 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4281 1.5095 -0.2211 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1653 1.7048 -1.4325 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9590 0.0900 -1.1798 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 2 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 18 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 6 39 1 0 6 40 1 0 7 41 1 0 7 42 1 0 8 43 1 0 8 44 1 0 9 45 1 0 10 46 1 0 11 47 1 0 11 48 1 0 12 49 1 0 13 50 1 0 14 51 1 0 14 52 1 0 18 53 1 6 19 54 1 0 19 55 1 0 23 56 1 0 23 57 1 0 25 58 1 0 25 59 1 0 25 60 1 0 26 61 1 0 26 62 1 0 26 63 1 0 27 64 1 0 27 65 1 0 27 66 1 0 M CHG 2 22 -1 24 1 M END