HMDB0285712 RDKit 3D PC(14:1(9Z)/PGE2) 129129 0 0 0 0 0 0 0 0999 V2000 2.6600 2.9888 0.6795 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6184 3.6251 1.6027 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3483 5.0389 1.2195 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3908 5.7868 2.0804 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8745 5.8543 3.4769 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2586 5.4996 4.5552 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0891 4.9388 4.6841 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 3.6113 5.3457 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5789 2.4499 4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2369 2.1377 3.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 1.8128 3.5093 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3425 1.4272 2.2131 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 2.5230 1.2186 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8958 2.1799 -0.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0786 2.5450 -0.2791 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2574 1.4767 -1.0771 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8196 1.1313 -2.3262 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7352 0.3484 -3.0537 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0124 0.2487 -4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3693 1.5297 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73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 12 78 1 0 13 79 1 0 13 80 1 0 17 81 1 0 17 82 1 0 18 83 1 6 19 84 1 0 19 85 1 0 25 86 1 0 25 87 1 0 26 88 1 0 26 89 1 0 28 90 1 0 28 91 1 0 28 92 1 0 29 93 1 0 29 94 1 0 29 95 1 0 30 96 1 0 30 97 1 0 30 98 1 0 34 99 1 0 34100 1 0 35101 1 0 35102 1 0 36103 1 0 36104 1 0 37105 1 0 38106 1 0 39107 1 0 39108 1 0 40109 1 1 43110 1 0 43111 1 0 44112 1 1 45113 1 0 46114 1 6 47115 1 0 48116 1 0 49117 1 1 50118 1 0 51119 1 0 51120 1 0 52121 1 0 52122 1 0 53123 1 0 53124 1 0 54125 1 0 54126 1 0 55127 1 0 55128 1 0 55129 1 0 M CHG 2 23 -1 27 1 M END