HMDB0241223 RDKit 3D (7E)-5-Hydroxydodec-7-enoylcarnitine 60 59 0 0 0 0 0 0 0 0999 V2000 8.7970 -0.2229 1.1688 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3962 -0.7475 0.9962 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4846 0.4000 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0421 -0.1307 0.4992 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2252 1.0361 0.1957 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5163 1.2108 -0.8737 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4211 0.2305 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9089 -0.1185 -2.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2821 1.0925 -2.2786 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6085 -0.7091 -0.7074 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2091 -1.1376 -0.4507 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7998 -0.0259 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -0.6286 -0.2218 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4951 -1.6097 -0.9173 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -0.1693 0.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2108 -0.5876 1.1712 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2402 -1.0595 2.6318 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3295 -2.1937 2.7958 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -2.7037 1.8807 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1963 -2.7435 4.0626 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.3064 0.4425 0.9805 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5198 0.8375 -0.3854 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.7385 1.6703 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4219 1.6603 -0.8185 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7804 -0.2969 -1.2446 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0669 0.3915 0.2994 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7744 0.4585 2.0613 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5178 -1.0694 1.3244 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3495 -1.4438 0.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9959 -1.2346 1.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 1.1958 1.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7975 0.8383 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7426 -0.6481 1.4434 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0743 -0.8229 -0.3527 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 1.8639 0.9419 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 2.1483 -1.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9844 -0.6885 -1.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7233 0.6834 -2.9491 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7322 -0.8357 -2.8604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8262 1.6703 -2.8532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9828 -0.0027 0.0744 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2585 -1.6295 -0.5952 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1982 -1.4887 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1006 -2.0223 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6262 0.7637 0.1956 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 0.3619 -1.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5254 -1.4641 0.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2887 -1.3470 2.8547 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9648 -0.1946 3.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2327 -0.0078 1.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1142 1.3634 1.5672 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 1.8107 -1.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4230 1.1678 0.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4335 2.6358 0.1364 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 1.8889 0.0148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8016 2.6574 -1.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8568 1.2011 -1.6506 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8643 -0.5776 -1.7979 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1911 -1.1209 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5942 0.0016 -1.9469 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 2 3 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 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 16 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 22 25 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 6 36 1 0 7 37 1 0 7 38 1 0 8 39 1 0 9 40 1 0 10 41 1 0 10 42 1 0 11 43 1 0 11 44 1 0 12 45 1 0 12 46 1 0 16 47 1 0 17 48 1 0 17 49 1 0 21 50 1 0 21 51 1 0 23 52 1 0 23 53 1 0 23 54 1 0 24 55 1 0 24 56 1 0 24 57 1 0 25 58 1 0 25 59 1 0 25 60 1 0 M CHG 2 20 -1 22 1 M END