HMDB0263874 RDKit 3D PA(18:3(10,12,15)-OH(9)/18:1(9Z)) 118117 0 0 0 0 0 0 0 0999 V2000 16.4877 -2.8471 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9557 -3.6088 -0.6917 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8568 -2.8427 -1.3784 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4823 -1.6547 -0.9261 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4005 -0.8785 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3071 -0.6568 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9376 0.5525 -0.2146 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8845 0.8058 0.7612 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5043 1.9936 1.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4480 2.2689 2.1084 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3499 1.3103 3.1001 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1006 2.4747 1.4836 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6571 1.2529 0.7155 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2854 1.4975 0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8272 0.3019 -0.6804 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5568 0.3320 -1.3998 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2538 0.4738 -0.7678 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8993 1.6533 0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4376 1.5538 0.4799 C 0 0 0 0 0 0 0 0 0 0 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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 1 0 26 27 2 0 26 28 1 0 26 29 1 0 23 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 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 2 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 1 50 1 0 1 51 1 0 1 52 1 0 2 53 1 0 2 54 1 0 3 55 1 0 4 56 1 0 5 57 1 0 5 58 1 0 6 59 1 0 7 60 1 0 8 61 1 0 9 62 1 0 10 63 1 0 11 64 1 0 12 65 1 0 12 66 1 0 13 67 1 0 13 68 1 0 14 69 1 0 14 70 1 0 15 71 1 0 15 72 1 0 16 73 1 0 16 74 1 0 17 75 1 0 17 76 1 0 18 77 1 0 18 78 1 0 22 79 1 0 22 80 1 0 23 81 1 1 24 82 1 0 24 83 1 0 28 84 1 0 29 85 1 0 33 86 1 0 33 87 1 0 34 88 1 0 34 89 1 0 35 90 1 0 35 91 1 0 36 92 1 0 36 93 1 0 37 94 1 0 37 95 1 0 38 96 1 0 38 97 1 0 39 98 1 0 39 99 1 0 40100 1 0 41101 1 0 42102 1 0 42103 1 0 43104 1 0 43105 1 0 44106 1 0 44107 1 0 45108 1 0 45109 1 0 46110 1 0 46111 1 0 47112 1 0 47113 1 0 48114 1 0 48115 1 0 49116 1 0 49117 1 0 49118 1 0 M END