HMDB0289039 RDKit 3D PC(6 keto-PGF1alpha/DiMe(11,5)) 153154 0 0 0 0 0 0 0 0999 V2000 4.9562 0.5992 -9.5981 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8504 -0.4069 -8.4682 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4848 0.1916 -7.2001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3994 -0.7616 -6.0646 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9956 -0.3228 -4.7684 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3756 0.9345 -4.2542 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4146 1.0394 -3.3643 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0888 2.2768 -3.1264 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0495 2.8086 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6753 3.3091 -0.9204 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6482 3.8383 0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9272 5.0166 -0.5537 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9277 5.6510 0.3407 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2315 4.8569 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1132 4.3516 -0.2946 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3575 3.6820 0.1089 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3768 2.4678 0.9154 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7771 1.2151 0.3676 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0374 0.1563 1.4085 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 -6.7661 -0.0401 8.8378 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3369 0.4025 7.6638 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4895 -0.1547 5.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1216 -1.1718 7.3852 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 4.8877 -3.6845 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6786 5.0173 -3.3585 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0277 4.9225 -5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2432 2.9728 -6.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2427 3.6064 -5.2149 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4634 1.8890 -5.7798 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 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 22 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 52 55 1 0 55 56 1 0 56 57 1 0 57 58 1 0 58 59 1 0 58 60 1 0 58 61 1 0 8 62 2 0 62 63 1 0 62 64 1 0 64 65 1 0 64 6 2 0 40 34 1 0 1 66 1 0 1 67 1 0 1 68 1 0 2 69 1 0 2 70 1 0 3 71 1 0 3 72 1 0 4 73 1 0 4 74 1 0 5 75 1 0 5 76 1 0 9 77 1 0 9 78 1 0 10 79 1 0 10 80 1 0 11 81 1 0 11 82 1 0 12 83 1 0 12 84 1 0 13 85 1 0 13 86 1 0 14 87 1 0 14 88 1 0 15 89 1 0 15 90 1 0 16 91 1 0 16 92 1 0 17 93 1 0 17 94 1 0 18 95 1 0 18 96 1 0 22 97 1 1 23 98 1 0 23 99 1 0 27100 1 0 27101 1 0 28102 1 0 28103 1 0 29104 1 0 29105 1 0 30106 1 0 30107 1 0 33108 1 0 33109 1 0 34110 1 6 35111 1 1 36112 1 0 37113 1 0 37114 1 0 38115 1 6 39116 1 0 40117 1 6 41118 1 0 42119 1 0 43120 1 6 44121 1 0 45122 1 0 45123 1 0 46124 1 0 46125 1 0 47126 1 0 47127 1 0 48128 1 0 48129 1 0 49130 1 0 49131 1 0 49132 1 0 50133 1 0 50134 1 0 56135 1 0 56136 1 0 57137 1 0 57138 1 0 59139 1 0 59140 1 0 59141 1 0 60142 1 0 60143 1 0 60144 1 0 61145 1 0 61146 1 0 61147 1 0 63148 1 0 63149 1 0 63150 1 0 65151 1 0 65152 1 0 65153 1 0 M CHG 2 54 -1 58 1 M END