HMDB0013339 RDKit 3D 3-Hydroxy-11Z-octadecenoylcarnitine 78 77 0 0 0 0 0 0 0 0999 V2000 8.4957 -1.6432 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1150 -0.4598 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8457 -0.5119 1.3231 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3429 -0.4919 1.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1466 -0.5486 -0.4079 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 -0.5351 -0.7428 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9919 0.6707 -0.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3625 1.5598 -1.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2783 1.4169 -2.4674 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8243 1.3250 -2.9575 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2198 0.1301 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7998 -0.1377 -2.6559 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 1.0729 -2.2475 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 0.7047 -2.6506 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3601 1.8671 -2.2789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7686 1.5325 -2.6744 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.7565 1.3166 -4.0618 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2634 0.3357 -1.9542 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2799 0.5619 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9971 1.6327 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6463 -0.5254 0.3083 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6978 -0.4066 1.7352 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6221 -1.3075 2.2913 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5039 -1.3034 3.7379 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1781 -0.5918 4.4808 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5707 -2.1556 4.3243 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.0621 -0.7715 2.2373 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1108 0.0657 1.6936 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.3224 -0.1970 2.4757 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8206 1.4688 1.7213 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3860 -0.3200 0.3129 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5993 -1.3635 4.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2715 -2.0605 4.1653 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1745 -2.4326 2.7473 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2190 -0.3912 2.9675 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6565 0.4905 3.1782 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3190 -1.3652 0.8127 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2752 0.4124 0.8578 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9196 -1.4434 1.4904 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 0.3861 1.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6051 -1.5015 -0.7397 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6618 0.3368 -0.8432 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5312 -0.8114 -1.7756 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2157 -1.3952 -0.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9691 0.9172 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8762 2.4482 -0.5582 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6817 2.3770 -2.9153 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 0.5914 -2.9257 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2976 2.2669 -2.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8927 1.1964 -4.0707 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3795 0.2072 -1.2082 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8229 -0.7623 -2.6414 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6962 -0.3581 -3.7185 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4401 -0.9843 -2.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2811 1.9926 -2.7562 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0456 1.2504 -1.1562 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6832 -0.2278 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4416 0.5155 -3.7405 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1953 2.0483 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9678 2.7316 -2.8902 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3796 2.4496 -2.4409 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9894 1.7582 -4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6642 -0.5791 -2.1407 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3129 0.1197 -2.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4366 0.6102 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6996 -2.3319 1.8546 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6324 -0.9328 1.8847 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3257 -1.8318 2.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1116 -0.6671 3.3282 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7387 -1.2005 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1030 -0.2602 3.5577 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1074 0.5495 2.2739 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 2.0011 2.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6568 1.8560 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0405 1.7748 2.4267 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1680 0.4931 -0.3955 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8488 -1.2192 -0.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4925 -0.5132 0.1812 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 2 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 16 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 22 27 1 0 27 28 1 0 28 29 1 0 28 30 1 0 28 31 1 0 1 32 1 0 1 33 1 0 1 34 1 0 2 35 1 0 2 36 1 0 3 37 1 0 3 38 1 0 4 39 1 0 4 40 1 0 5 41 1 0 5 42 1 0 6 43 1 0 6 44 1 0 7 45 1 0 8 46 1 0 9 47 1 0 9 48 1 0 10 49 1 0 10 50 1 0 11 51 1 0 11 52 1 0 12 53 1 0 12 54 1 0 13 55 1 0 13 56 1 0 14 57 1 0 14 58 1 0 15 59 1 0 15 60 1 0 16 61 1 6 17 62 1 0 18 63 1 0 18 64 1 0 22 65 1 6 23 66 1 0 23 67 1 0 27 68 1 0 27 69 1 0 29 70 1 0 29 71 1 0 29 72 1 0 30 73 1 0 30 74 1 0 30 75 1 0 31 76 1 0 31 77 1 0 31 78 1 0 M CHG 2 26 -1 28 1 M END