HMDB0241463 RDKit 3D 9-Hydroxyhexadecanoylcarnitine 74 73 0 0 0 0 0 0 0 0999 V2000 10.4125 0.7276 -2.2465 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7620 -0.4425 -1.5418 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4523 -0.0123 -0.8895 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7864 -1.1412 -0.1876 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4758 -0.7917 0.4792 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4953 -0.3069 -0.5187 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1401 0.0468 -0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0313 1.1191 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7406 0.7706 2.1165 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5664 1.2128 1.4281 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6386 1.5470 0.3093 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1939 1.6274 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3015 0.3279 1.3705 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7167 0.5432 1.8632 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3153 -0.6853 2.4485 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4727 -1.8501 1.5326 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -1.4404 0.4175 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8863 -1.1529 -0.6938 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7495 -1.3759 0.5971 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5863 -0.9851 -0.4761 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5885 -2.1338 -0.6423 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8983 -3.4041 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3998 -3.5757 -2.0809 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7877 -4.4137 -0.0125 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.2860 0.2650 -0.0111 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2001 0.8630 -0.9128 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.1778 2.3170 -0.6309 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9652 0.6890 -2.3075 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5678 0.4120 -0.6405 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6031 0.5072 -3.3188 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3075 1.0622 -1.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6917 1.5848 -2.2053 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4668 -0.8512 -0.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5603 -1.2752 -2.2757 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8392 0.5043 -1.6476 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7346 0.7698 -0.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6338 -1.9896 -0.9216 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5194 -1.5600 0.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0612 -1.7102 0.9576 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7033 -0.0757 1.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9239 0.5362 -1.1029 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3601 -1.1267 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5094 0.3613 -0.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5833 -0.8431 0.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2937 2.1307 0.6098 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1317 0.4375 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2686 0.2547 1.8946 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5437 1.9994 2.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6261 0.8641 -0.5358 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8575 2.5933 -0.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1675 2.4338 1.5853 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4061 1.9994 -0.0228 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2812 -0.4144 0.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3587 -0.0385 2.1505 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6597 1.3032 2.6684 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3122 0.9906 1.0557 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3552 -0.4080 2.7902 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7935 -0.9628 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9855 -2.6524 2.0975 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5378 -2.2842 1.1484 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9621 -0.8257 -1.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3548 -1.9101 -1.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1479 -2.2736 0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4614 0.9809 0.2806 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7982 0.0255 0.9356 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1297 2.6963 -1.0478 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1747 2.4993 0.4619 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3225 2.7930 -1.1167 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1693 1.6775 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 0.4775 -2.5475 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6739 -0.0074 -2.8026 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0185 -0.0902 -1.5239 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5306 -0.2417 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1662 1.3015 -0.3830 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 8 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 4 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 6 42 1 0 7 43 1 0 7 44 1 0 8 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