HMDB0289523 RDKit 3D PC(P-16:0/20:3(6,8,11)-OH(5)) 136135 0 0 0 0 0 0 0 0999 V2000 -0.0806 0.7718 -2.6189 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2013 1.0323 -3.6223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7266 0.7452 -5.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7626 0.9568 -6.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2837 2.3889 -6.1393 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 2.5164 -7.2378 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5141 1.6913 -7.1526 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5281 1.9442 -6.1364 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2878 1.9404 -4.7165 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8853 1.0675 -3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6229 1.0998 -2.4272 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7023 2.1952 -2.0515 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5476 2.0472 -1.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7141 3.1976 -1.1141 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5507 3.0940 -0.4977 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7197 4.2975 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9326 5.3051 -1.1257 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7178 3.9180 -0.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1346 2.8585 0.7603 C 0 0 0 0 0 0 0 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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 24 43 1 0 43 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 45 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 51 53 1 0 51 54 1 0 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 2 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 6 67 1 0 7 68 1 0 7 69 1 0 8 70 1 0 8 71 1 0 9 72 1 0 10 73 1 0 11 74 1 0 11 75 1 0 12 76 1 0 13 77 1 0 14 78 1 0 15 79 1 0 16 80 1 0 17 81 1 0 18 82 1 0 18 83 1 0 19 84 1 0 19 85 1 0 20 86 1 0 20 87 1 0 24 88 1 1 25 89 1 0 25 90 1 0 27 91 1 0 28 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 32100 1 0 33101 1 0 33102 1 0 34103 1 0 34104 1 0 35105 1 0 35106 1 0 36107 1 0 36108 1 0 37109 1 0 37110 1 0 38111 1 0 38112 1 0 39113 1 0 39114 1 0 40115 1 0 40116 1 0 41117 1 0 41118 1 0 42119 1 0 42120 1 0 42121 1 0 43122 1 0 43123 1 0 49124 1 0 49125 1 0 50126 1 0 50127 1 0 52128 1 0 52129 1 0 52130 1 0 53131 1 0 53132 1 0 53133 1 0 54134 1 0 54135 1 0 54136 1 0 M CHG 2 47 -1 51 1 M END