HMDB0241428 RDKit 3D 3-hydroxytetradecanedioylcarnitine 68 67 0 0 0 0 0 0 0 0999 V2000 -6.1415 -0.2264 1.3429 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2338 -0.8949 0.0827 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.6460 -1.1974 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4832 -2.1400 0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -0.1255 -1.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6065 0.7690 -0.7781 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1842 1.5081 -2.0378 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 2.3868 -2.5985 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9917 2.9074 -3.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3838 2.6526 -1.9523 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.4995 -0.0054 -0.3469 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7841 0.3044 0.8112 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1468 1.3038 1.4699 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6382 -0.5312 1.2249 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 0.3827 1.3889 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1109 1.0410 0.2192 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6838 -0.2229 2.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2971 -1.4440 1.6242 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9385 -1.5564 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1443 -0.7744 -0.0258 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0776 0.6901 -0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4067 1.3024 -0.4476 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4562 1.0064 0.5841 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 1.6583 0.2666 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4625 1.2033 -0.9476 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9711 -0.1936 -0.9223 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -1.2367 -0.7982 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0019 -1.2503 -1.5879 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0505 -2.2436 0.1716 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2796 -0.5671 1.9759 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0466 -0.5074 1.9615 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1621 0.8746 1.3007 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2307 -0.3876 0.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8716 -2.1947 0.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7848 -1.2483 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9543 -2.7869 0.9137 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6204 -2.6358 -0.8379 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4414 -2.0026 0.4209 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6509 0.4699 -1.4328 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5422 -0.8128 -1.9032 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7766 1.5390 0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8326 0.7367 -2.7698 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3123 2.1632 -1.7522 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4784 -1.3868 0.5682 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8638 -0.9303 2.2526 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8359 1.2098 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1976 1.9623 0.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1986 -0.5429 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3528 0.5913 2.4942 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5143 -2.2784 1.7623 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -1.7682 2.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -2.6547 0.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2333 -1.4550 -0.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0607 -1.1571 0.5125 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3818 -1.1027 -1.1075 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3534 1.0708 -0.8541 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7714 1.2173 0.8482 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2459 2.4358 -0.3736 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7087 1.0636 -1.4766 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5654 -0.0461 0.8179 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1361 1.4901 1.5716 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4033 1.5611 1.1957 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6102 2.7813 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7385 1.2429 -1.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2828 1.9357 -1.2034 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5498 -0.3389 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7937 -0.3178 -0.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3268 -2.2972 0.8607 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 2 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 6 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 15 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 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 4 37 1 0 4 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 7 42 1 0 7 43 1 0 14 44 1 0 14 45 1 0 15 46 1 0 16 47 1 0 17 48 1 0 17 49 1 0 18 50 1 0 18 51 1 0 19 52 1 0 19 53 1 0 20 54 1 0 20 55 1 0 21 56 1 0 21 57 1 0 22 58 1 0 22 59 1 0 23 60 1 0 23 61 1 0 24 62 1 0 24 63 1 0 25 64 1 0 25 65 1 0 26 66 1 0 26 67 1 0 29 68 1 0 M CHG 2 2 1 10 -1 M END