HMDB0289346 RDKit 3D PC(PGE2/DiMe(9,5)) 144145 0 0 0 0 0 0 0 0999 V2000 4.1476 -5.3814 -1.2094 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4195 -5.0538 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3004 -4.1355 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6149 -2.8350 0.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 -1.8670 0.0504 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8489 -1.3724 1.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2028 -0.2415 1.8447 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4933 0.0214 2.9459 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6998 1.2361 3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7747 2.3301 3.5145 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3233 2.2045 3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1374 1.9598 5.3323 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2475 1.9094 5.8229 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1889 0.9336 5.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5071 1.0555 5.9624 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5945 0.2012 5.4234 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0625 0.5345 4.0762 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8254 1.5550 3.9286 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7441 -0.1718 2.9573 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 0.1855 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0 0 0 0 0 0 0 0 0 0 1.5411 -4.0781 2.1750 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 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 20 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 49 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 55 57 1 0 55 58 1 0 8 59 2 0 59 60 1 0 59 61 1 0 61 62 1 0 61 6 2 0 37 31 1 0 1 63 1 0 1 64 1 0 1 65 1 0 2 66 1 0 2 67 1 0 3 68 1 0 3 69 1 0 4 70 1 0 4 71 1 0 5 72 1 0 5 73 1 0 9 74 1 0 9 75 1 0 10 76 1 0 10 77 1 0 11 78 1 0 11 79 1 0 12 80 1 0 12 81 1 0 13 82 1 0 13 83 1 0 14 84 1 0 14 85 1 0 15 86 1 0 15 87 1 0 16 88 1 0 16 89 1 0 20 90 1 1 21 91 1 0 21 92 1 0 25 93 1 0 25 94 1 0 26 95 1 0 26 96 1 0 27 97 1 0 27 98 1 0 28 99 1 0 29100 1 0 30101 1 0 30102 1 0 31103 1 1 34104 1 0 34105 1 0 35106 1 6 36107 1 0 37108 1 6 38109 1 0 39110 1 0 40111 1 1 41112 1 0 42113 1 0 42114 1 0 43115 1 0 43116 1 0 44117 1 0 44118 1 0 45119 1 0 45120 1 0 46121 1 0 46122 1 0 46123 1 0 47124 1 0 47125 1 0 53126 1 0 53127 1 0 54128 1 0 54129 1 0 56130 1 0 56131 1 0 56132 1 0 57133 1 0 57134 1 0 57135 1 0 58136 1 0 58137 1 0 58138 1 0 60139 1 0 60140 1 0 60141 1 0 62142 1 0 62143 1 0 62144 1 0 M CHG 2 51 -1 55 1 M END