HMDB0241756 RDKit 3D Non-5-enedioylcarnitine 50 49 0 0 0 0 0 0 0 0999 V2000 -4.9403 1.6681 0.1065 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9987 0.9926 1.0175 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.8052 1.9842 2.0972 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5495 -0.1531 1.6271 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7441 0.8672 0.3692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4923 -0.4022 -0.3605 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4613 -0.7408 -1.4517 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5292 0.2514 -2.5458 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8463 1.3032 -2.6016 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4098 0.0033 -3.5847 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.2091 -0.3944 -0.9611 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2315 -1.3208 -0.7134 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4556 -2.2416 0.0892 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1123 -1.2836 -1.3684 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9774 -2.4213 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3448 -2.4193 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2101 -1.2913 -1.1397 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9489 -0.3481 -0.2685 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 0.7344 0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2907 0.6478 1.5215 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2688 1.7103 1.8716 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0103 2.9205 1.6772 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4894 1.3498 2.4213 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6179 2.3536 0.6866 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5939 0.9671 -0.4183 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3209 2.3210 -0.5211 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6246 2.9883 1.7071 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9551 1.6649 2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7088 1.9442 2.7742 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6709 -0.0807 1.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2707 -1.1354 1.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3604 -0.1670 2.7433 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9474 0.9458 1.1726 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 1.7102 -0.3465 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4826 -1.3032 0.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4667 -1.0374 -1.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0636 -1.6989 -1.9093 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -0.2975 -1.3753 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8563 -1.5164 -2.4669 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1259 -2.3489 0.1783 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4927 -3.4116 -1.0871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8914 -3.3666 -1.2912 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1827 -2.3867 -2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2112 -1.2354 -1.6379 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0322 -0.3353 0.2811 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3478 1.6925 -0.0725 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8157 0.7033 -0.5864 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3942 0.8220 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6854 -0.3477 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2544 1.1397 1.7919 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 16 17 1 0 17 18 2 3 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 7 36 1 0 7 37 1 0 14 38 1 0 14 39 1 0 15 40 1 0 15 41 1 0 16 42 1 0 16 43 1 0 17 44 1 0 18 45 1 0 19 46 1 0 19 47 1 0 20 48 1 0 20 49 1 0 23 50 1 0 M CHG 2 2 1 10 -1 M END