HMDB0289331 RDKit 3D PC(DiMe(9,5)/20:4(5Z,8Z,11Z,14Z)-OH(18R)) 142142 0 0 0 0 0 0 0 0999 V2000 0.0701 0.1169 -3.6774 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5604 -0.8475 -4.6326 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0741 -2.0886 -3.9564 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1404 -1.7957 -2.9125 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5564 -3.1281 -2.3108 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6051 -2.9877 -1.2752 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4901 -3.0444 0.0048 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6295 -2.8778 0.6276 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8343 -2.8886 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0365 -1.4887 2.6423 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8501 -0.6014 2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5797 -1.0869 2.9604 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5944 -1.1762 4.4728 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2805 -1.6966 5.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1159 -0.8432 4.6117 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1364 -1.4920 5.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -0.7074 4.7727 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -0.0123 5.5661 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7898 -0.7377 3.4642 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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 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 24 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 33 1 0 21 34 1 0 34 35 1 0 35 36 2 0 35 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 2 0 44 45 1 0 45 46 1 0 46 47 2 0 47 48 1 0 48 49 1 0 49 50 2 0 50 51 1 0 51 52 1 0 52 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 8 57 2 0 57 58 1 0 57 59 1 0 59 60 1 0 59 6 2 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 9 72 1 0 9 73 1 0 10 74 1 0 10 75 1 0 11 76 1 0 11 77 1 0 12 78 1 0 12 79 1 0 13 80 1 0 13 81 1 0 14 82 1 0 14 83 1 0 15 84 1 0 15 85 1 0 16 86 1 0 16 87 1 0 20 88 1 0 20 89 1 0 21 90 1 6 22 91 1 0 22 92 1 0 28 93 1 0 28 94 1 0 29 95 1 0 29 96 1 0 31 97 1 0 31 98 1 0 31 99 1 0 32100 1 0 32101 1 0 32102 1 0 33103 1 0 33104 1 0 33105 1 0 37106 1 0 37107 1 0 38108 1 0 38109 1 0 39110 1 0 39111 1 0 40112 1 0 41113 1 0 42114 1 0 42115 1 0 43116 1 0 44117 1 0 45118 1 0 45119 1 0 46120 1 0 47121 1 0 48122 1 0 48123 1 0 49124 1 0 50125 1 0 51126 1 0 51127 1 0 52128 1 0 52129 1 0 53130 1 1 54131 1 0 55132 1 0 55133 1 0 56134 1 0 56135 1 0 56136 1 0 58137 1 0 58138 1 0 58139 1 0 60140 1 0 60141 1 0 60142 1 0 M CHG 2 26 -1 30 1 M END