HMDB0241467 RDKit 3D 13-Hydroxyhexadecanoylcarnitine 74 73 0 0 0 0 0 0 0 0999 V2000 9.4040 -0.1091 -1.5067 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6054 0.5467 -2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2471 1.0143 -2.1264 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4509 -0.1454 -1.6289 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -0.7157 -0.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0245 0.0805 -1.3563 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6604 1.1062 -0.3301 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1519 0.8253 1.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7477 -0.4054 1.7424 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3777 -0.7089 2.1447 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3551 -0.8042 1.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0076 -1.2666 1.6798 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5716 -0.2761 2.7051 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7586 -0.7164 3.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7916 -0.7982 2.2041 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 0.5243 1.5049 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0667 0.3317 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7729 -0.3910 -0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3107 0.9047 0.5219 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2645 0.6409 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5343 2.0451 -1.0651 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4292 2.2318 -2.1857 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5798 2.7501 -2.0203 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1118 1.8710 -3.4923 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.4129 0.0165 0.1148 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5130 -0.4728 -0.6205 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.7444 0.2718 -0.4819 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8280 -1.8083 -0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3099 -0.7448 -2.0134 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5046 -0.0659 -1.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2647 0.3981 -0.5511 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2099 -1.1986 -1.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4396 -0.2494 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1936 1.3758 -3.0411 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4368 1.7807 -1.3322 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8006 1.5578 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4975 -0.9454 -2.4378 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0031 -1.6790 -0.4719 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5435 -0.8800 -1.0595 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4641 0.3665 -2.2966 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0555 2.1337 -0.6691 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5887 1.2665 -0.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3024 0.7920 1.0142 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8994 1.7280 1.7254 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0586 -1.2885 1.0496 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -0.6226 2.6216 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4041 -1.6781 2.7245 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1015 0.0460 2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6614 -1.4540 0.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0948 0.2443 0.7387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -2.2761 2.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3172 -1.2464 0.8065 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4625 0.7395 2.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2661 -0.2673 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0512 0.0664 4.0213 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5754 -1.6912 3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5655 -1.5392 1.4162 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7605 -1.1682 2.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4307 1.2457 2.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1074 0.9434 1.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7472 0.0057 -1.3007 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5424 2.5231 -1.3687 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8376 2.6895 -0.1905 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8537 0.7797 0.8517 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0651 -0.7942 0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5135 -0.3690 -0.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1539 0.5822 -1.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6134 1.1291 0.2142 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7991 -2.1627 -0.3591 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9798 -2.5028 -0.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8752 -1.5832 1.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2981 -0.6299 -2.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9813 -0.1064 -2.6609 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6368 -1.7933 -2.3062 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 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 9 46 1 0 10 47 1 0 10 48 1 0 11 49 1 0 11 50 1 0 12 51 1 0 12 52 1 0 13 53 1 0 13 54 1 0 14 55 1 0 14 56 1 0 15 57 1 0 15 58 1 0 16 59 1 0 16 60 1 0 20 61 1 0 21 62 1 0 21 63 1 0 25 64 1 0 25 65 1 0 27 66 1 0 27 67 1 0 27 68 1 0 28 69 1 0 28 70 1 0 28 71 1 0 29 72 1 0 29 73 1 0 29 74 1 0 M CHG 2 24 -1 26 1 M END