HMDB0241390 RDKit 3D 2-Hydroxytrtradeca-4,6-dienoylcarnitine 64 63 0 0 0 0 0 0 0 0999 V2000 8.8873 1.6686 -0.1187 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6402 1.4339 -1.5703 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1754 1.0381 -1.7865 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9688 -0.2129 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5376 -0.7342 -1.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4381 -1.9600 -0.2408 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1123 -2.6146 -0.2094 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 -1.9161 0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0983 -0.7260 1.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9286 -0.1476 1.5597 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9104 0.3559 2.0252 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4575 -0.3397 1.9357 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4124 0.4632 1.1138 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6856 1.7258 1.5313 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5999 -0.3725 0.8226 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4989 -1.6159 1.0888 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7945 0.0354 0.2946 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8937 -0.8195 0.0646 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8897 -1.3966 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 -0.4379 -2.4422 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0335 -0.2879 -3.0551 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8631 0.3264 -2.8605 O 0 0 0 0 0 1 0 0 0 0 0 0 -6.1747 -0.4641 0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8335 0.7423 0.3645 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.0841 1.8140 -0.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0669 0.5717 -0.4079 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3435 1.2707 1.6615 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9318 1.9936 0.3396 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6947 2.4348 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1715 0.7299 0.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2354 0.6034 -1.9453 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9091 2.3159 -2.1924 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4940 1.8599 -1.4989 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0848 0.7795 -2.8789 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2813 -0.0545 0.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6185 -1.0022 -1.4371 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8237 0.0417 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4924 -1.1274 -2.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1922 -2.7331 -0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7027 -1.6624 0.7956 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -2.7806 -1.3063 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1988 -3.6849 0.1718 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9767 -2.3301 0.3581 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0991 -0.3558 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6592 0.9766 1.9508 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7745 1.3150 2.5667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3256 -1.3097 1.4162 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8564 -0.5120 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8494 0.5888 0.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6706 1.8664 1.6402 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5596 -1.7863 0.6457 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7005 -2.1854 -1.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 -2.0216 -1.5053 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0423 -0.5321 1.7859 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8933 -1.3014 0.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1227 1.8542 -1.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0863 1.9670 0.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 2.7684 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5523 -0.3841 -0.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9552 0.7254 -1.4752 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7904 1.3747 -0.0752 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4711 1.3427 2.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7531 2.2607 1.4831 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0521 0.5643 2.1281 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 2 3 9 10 1 0 10 11 2 3 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 18 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 6 39 1 0 6 40 1 0 7 41 1 0 7 42 1 0 8 43 1 0 9 44 1 0 10 45 1 0 11 46 1 0 12 47 1 0 12 48 1 0 13 49 1 0 14 50 1 0 18 51 1 0 19 52 1 0 19 53 1 0 23 54 1 0 23 55 1 0 25 56 1 0 25 57 1 0 25 58 1 0 26 59 1 0 26 60 1 0 26 61 1 0 27 62 1 0 27 63 1 0 27 64 1 0 M CHG 2 22 -1 24 1 M END