HMDB0241574 RDKit 3D 3-Hydroxyicos-11-enoylcarnitine 84 83 0 0 0 0 0 0 0 0999 V2000 11.8934 -1.4078 -1.7816 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1142 -0.1375 -1.9763 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1820 0.0499 -0.7433 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4047 1.3069 -0.9266 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4970 1.7638 0.1246 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3378 0.9899 0.5816 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5212 -0.3332 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1468 -0.9100 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3044 -1.0531 0.4671 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1523 -0.4836 0.2229 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5072 0.4400 1.1751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1621 -0.1788 1.5387 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4778 0.7222 2.5226 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2487 2.0743 1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 2.0214 0.7291 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9094 1.4022 1.0377 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8011 1.3459 -0.2165 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0861 0.7121 0.2121 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7618 -0.5757 0.6984 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0836 0.5261 -0.8781 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2986 -0.1057 -0.3204 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -0.3808 0.9015 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4274 -0.4221 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5720 -1.0384 -0.4387 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7015 -2.3798 -1.0733 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9012 -2.3156 -2.5515 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0715 -3.3647 -3.2371 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9129 -1.1295 -3.2591 O 0 0 0 0 0 1 0 0 0 0 0 0 -8.7290 -0.1259 -0.5534 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9486 -0.5753 0.0394 N 0 0 0 0 0 4 0 0 0 0 0 0 -10.7617 0.6445 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7587 -1.3894 -0.8272 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8128 -1.2106 1.3167 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6235 -2.1567 -2.5776 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9678 -1.1933 -1.9261 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6659 -1.9123 -0.8223 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4530 -0.2160 -2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7407 0.7693 -2.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5382 -0.8729 -0.8299 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7953 -0.0032 0.1492 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1678 2.1357 -1.1483 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8844 1.2289 -1.9307 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0743 2.7855 -0.2093 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0981 2.0900 1.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7978 1.6419 1.3504 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5541 0.9420 -0.2397 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1026 -0.2868 2.1443 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9199 -1.1007 0.5687 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 -1.9622 1.9848 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7615 -0.3471 2.4956 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6528 -1.7296 -0.3675 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6019 -0.6642 -0.7096 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3226 1.4473 0.6911 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1432 0.5724 2.0545 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5277 -0.2935 0.6389 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -1.2065 1.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5565 0.2330 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1781 0.8681 3.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6136 2.6242 2.7328 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1653 2.6503 1.7551 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9503 1.4798 -0.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2366 3.0549 0.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4682 1.9188 1.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7403 0.3502 1.3956 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 0.7733 -1.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0058 2.4048 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5527 1.2700 1.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7729 -0.6109 1.6729 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 1.4645 -1.4285 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6678 -0.1705 -1.6637 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3528 -1.1812 0.6546 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4823 -3.0337 -0.6909 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7435 -2.9765 -0.9533 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8914 0.1664 -1.6141 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4480 0.8165 0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7634 0.2987 0.5985 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8399 1.1555 -0.7003 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2731 1.2654 1.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7821 -2.4675 -0.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8470 -1.0828 -0.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4790 -1.2114 -1.8857 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7012 -0.4787 2.1513 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0585 -2.0120 1.3687 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7976 -1.7190 1.5260 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 3 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 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 24 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 33 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 3 39 1 0 3 40 1 0 4 41 1 0 4 42 1 0 5 43 1 0 5 44 1 0 6 45 1 0 6 46 1 0 7 47 1 0 7 48 1 0 8 49 1 0 8 50 1 0 9 51 1 0 10 52 1 0 11 53 1 0 11 54 1 0 12 55 1 0 12 56 1 0 13 57 1 0 13 58 1 0 14 59 1 0 14 60 1 0 15 61 1 0 15 62 1 0 16 63 1 0 16 64 1 0 17 65 1 0 17 66 1 0 18 67 1 0 19 68 1 0 20 69 1 0 20 70 1 0 24 71 1 0 25 72 1 0 25 73 1 0 29 74 1 0 29 75 1 0 31 76 1 0 31 77 1 0 31 78 1 0 32 79 1 0 32 80 1 0 32 81 1 0 33 82 1 0 33 83 1 0 33 84 1 0 M CHG 2 28 -1 30 1 M END