HMDB0274398 RDKit 3D PGP(a-15:0/6 keto-PGF1alpha) 136136 0 0 0 0 0 0 0 0999 V2000 -2.3887 -2.8401 4.4512 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9206 -2.7592 4.1156 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3006 -1.5027 4.6293 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8954 -0.2428 4.0766 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 -0.1970 2.5815 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2987 1.0755 1.9916 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6489 1.2495 2.2102 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8909 1.2436 0.5742 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0593 2.2147 0.1962 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4283 2.5000 -1.1413 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0368 1.5706 -2.2279 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9068 1.6682 -3.2753 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3229 2.2170 -2.6747 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0532 3.7120 -2.5800 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6474 4.1379 -3.8482 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0528 3.8956 -1.5936 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2799 4.5315 -2.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3786 4.5889 -1.2918 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1534 4.4103 -0.1197 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7937 4.8583 -1.7045 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4086 3.5236 -2.1592 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8398 3.7165 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4904 2.4693 -3.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4497 1.3209 -2.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4620 0.7990 -1.5673 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2163 0.7922 -1.7847 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9584 -0.3060 -0.9478 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3707 -1.3607 -1.8148 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2211 -0.9640 -2.5344 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6113 -1.8803 -3.4149 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1516 -3.0065 -3.4599 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4392 -1.5438 -4.2272 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8952 -2.6768 -4.9922 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1783 -3.7797 -4.3607 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7298 -4.5862 -3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2952 -5.6834 -2.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6502 -5.2256 -2.6447 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8543 -4.3234 -1.4775 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -4.0443 -1.4519 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7416 -3.1314 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1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 27 46 1 0 46 47 1 0 47 48 1 0 48 49 2 0 48 50 1 0 48 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 56 57 1 0 57 58 2 0 57 59 1 0 57 60 1 0 16 10 1 0 1 61 1 0 1 62 1 0 1 63 1 0 2 64 1 0 2 65 1 0 3 66 1 0 3 67 1 0 4 68 1 0 4 69 1 0 5 70 1 0 5 71 1 0 6 72 1 1 7 73 1 0 8 74 1 0 9 75 1 0 10 76 1 1 11 77 1 1 12 78 1 0 13 79 1 0 13 80 1 0 14 81 1 1 15 82 1 0 16 83 1 1 17 84 1 0 17 85 1 0 20 86 1 0 20 87 1 0 21 88 1 0 21 89 1 0 22 90 1 0 22 91 1 0 23 92 1 0 23 93 1 0 27 94 1 1 28 95 1 0 28 96 1 0 32 97 1 0 32 98 1 0 33 99 1 0 33100 1 0 34101 1 0 34102 1 0 35103 1 0 35104 1 0 36105 1 0 36106 1 0 37107 1 0 37108 1 0 38109 1 0 38110 1 0 39111 1 0 39112 1 0 40113 1 0 40114 1 0 41115 1 0 41116 1 0 42117 1 0 43118 1 0 43119 1 0 43120 1 0 44121 1 0 44122 1 0 45123 1 0 45124 1 0 45125 1 0 46126 1 0 46127 1 0 50128 1 0 52129 1 0 52130 1 0 53131 1 1 54132 1 0 55133 1 0 55134 1 0 59135 1 0 60136 1 0 M END