HMDB0284743 RDKit 3D PE(PGE1/DiMe(11,3)) 137138 0 0 0 0 0 0 0 0999 V2000 -1.6367 7.9651 -2.3791 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0673 7.9108 -2.7951 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8065 6.6466 -2.5559 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9895 6.1989 -1.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7227 5.9261 -0.3745 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0734 5.4188 1.0278 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8021 6.3779 1.7122 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8967 4.9632 1.7985 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7503 4.6595 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4759 4.1802 2.0299 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0780 3.7858 3.4100 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2636 4.8152 4.3156 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0104 2.6173 3.7592 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5409 2.1566 2.4694 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4842 1.3774 2.2741 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7206 2.8096 1.3702 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6245 2.9537 0.1654 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7338 1.6042 -0.5894 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3807 1.3279 -1.2001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3911 0.0095 -1.9421 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9524 -0.0714 -2.6445 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2049 -1.3142 -3.3868 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2908 -2.5404 -2.5363 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4069 -3.4186 -2.5211 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3974 -2.6906 -1.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7667 -3.6881 -0.8985 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7867 -4.0609 0.2016 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5536 -5.1320 1.0188 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6875 -4.4595 1.5058 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -5.4207 2.4125 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.9771 -6.3542 3.3424 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7066 -6.3633 1.4157 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7624 -4.4619 3.3498 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3845 -4.5919 4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2643 -3.7445 5.5726 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6612 -4.1027 5.4977 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4477 -2.9965 1.0335 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1529 -2.4808 1.1373 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6963 -3.0271 0.4032 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1363 -1.3832 2.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -1.6283 3.4238 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9082 -2.2410 3.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1946 -3.6003 3.2506 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6321 -4.0382 3.6195 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6031 -3.0299 3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -2.8395 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4034 -1.8160 1.0573 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2422 -1.4341 -0.3836 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3735 -2.6164 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1924 -2.2723 -2.7016 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1944 -1.1088 -3.2917 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -1.2106 -4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9189 -0.1676 -5.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3627 1.1481 -5.1292 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2615 1.7255 -4.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8522 -2.5620 -4.8791 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6044 -3.1466 -6.2477 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9802 -3.2163 -3.6697 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8952 -4.7047 -3.5176 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 8.4462 -3.2152 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1361 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0 30 31 2 0 30 32 1 0 30 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 27 37 1 0 37 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 52 56 2 0 56 57 1 0 56 58 1 0 58 59 1 0 16 10 1 0 58 50 2 0 1 60 1 0 1 61 1 0 1 62 1 0 2 63 1 0 2 64 1 0 3 65 1 0 3 66 1 0 4 67 1 0 4 68 1 0 5 69 1 0 5 70 1 0 6 71 1 6 7 72 1 0 8 73 1 0 9 74 1 0 10 75 1 1 11 76 1 6 12 77 1 0 13 78 1 0 13 79 1 0 16 80 1 6 17 81 1 0 17 82 1 0 18 83 1 0 18 84 1 0 19 85 1 0 19 86 1 0 20 87 1 0 20 88 1 0 21 89 1 0 21 90 1 0 22 91 1 0 22 92 1 0 26 93 1 0 26 94 1 0 27 95 1 6 28 96 1 0 28 97 1 0 32 98 1 0 34 99 1 0 34100 1 0 35101 1 0 35102 1 0 36103 1 0 36104 1 0 40105 1 0 40106 1 0 41107 1 0 41108 1 0 42109 1 0 42110 1 0 43111 1 0 43112 1 0 44113 1 0 44114 1 0 45115 1 0 45116 1 0 46117 1 0 46118 1 0 47119 1 0 47120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 53125 1 0 53126 1 0 54127 1 0 54128 1 0 55129 1 0 55130 1 0 55131 1 0 57132 1 0 57133 1 0 57134 1 0 59135 1 0 59136 1 0 59137 1 0 M END