HMDB0289138 RDKit 3D PC(PGE2/DiMe(13,5)) 156157 0 0 0 0 0 0 0 0999 V2000 5.8254 -1.1365 -3.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6377 -0.6043 -2.4499 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1324 -1.6253 -1.4271 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9551 -0.9943 -0.7168 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3451 -1.8790 0.3133 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1965 -1.1333 0.9445 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -0.5129 2.0801 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0632 0.0597 2.3824 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1484 0.8289 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7505 0.0540 4.7559 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1587 -0.3706 4.5274 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6092 -1.2221 5.7413 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8644 -2.5417 5.7274 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3585 -3.4391 4.6213 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5152 -4.6635 4.5172 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1716 -5.6970 3.5822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2678 -6.8658 3.3498 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -6.5138 2.4379 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6199 -6.2237 1.0561 C 0 0 0 0 0 0 0 0 0 0 0 0 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1 0 35 36 1 0 36 37 2 0 36 38 1 0 38 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 2 0 43 44 1 0 44 45 1 0 44 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 24 51 1 0 51 52 1 0 52 53 1 0 53 54 2 0 53 55 1 0 53 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 59 61 1 0 59 62 1 0 8 63 2 0 63 64 1 0 63 65 1 0 65 66 1 0 65 6 2 0 41 35 1 0 1 67 1 0 1 68 1 0 1 69 1 0 2 70 1 0 2 71 1 0 3 72 1 0 3 73 1 0 4 74 1 0 4 75 1 0 5 76 1 0 5 77 1 0 9 78 1 0 9 79 1 0 10 80 1 0 10 81 1 0 11 82 1 0 11 83 1 0 12 84 1 0 12 85 1 0 13 86 1 0 13 87 1 0 14 88 1 0 14 89 1 0 15 90 1 0 15 91 1 0 16 92 1 0 16 93 1 0 17 94 1 0 17 95 1 0 18 96 1 0 18 97 1 0 19 98 1 0 19 99 1 0 20100 1 0 20101 1 0 24102 1 6 25103 1 0 25104 1 0 29105 1 0 29106 1 0 30107 1 0 30108 1 0 31109 1 0 31110 1 0 32111 1 0 33112 1 0 34113 1 0 34114 1 0 35115 1 6 38116 1 0 38117 1 0 39118 1 6 40119 1 0 41120 1 1 42121 1 0 43122 1 0 44123 1 6 45124 1 0 46125 1 0 46126 1 0 47127 1 0 47128 1 0 48129 1 0 48130 1 0 49131 1 0 49132 1 0 50133 1 0 50134 1 0 50135 1 0 51136 1 0 51137 1 0 57138 1 0 57139 1 0 58140 1 0 58141 1 0 60142 1 0 60143 1 0 60144 1 0 61145 1 0 61146 1 0 61147 1 0 62148 1 0 62149 1 0 62150 1 0 64151 1 0 64152 1 0 64153 1 0 66154 1 0 66155 1 0 66156 1 0 M CHG 2 55 -1 59 1 M END