HMDB0289279 RDKit 3D PC(DiMe(9,3)/20:5(5Z,8Z,11Z,14Z,16E)-OH(18)) 134134 0 0 0 0 0 0 0 0999 V2000 4.5429 -3.0171 3.6406 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5929 -3.7670 2.3015 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8604 -3.4361 1.6581 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8912 -2.8331 0.4853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6407 -2.4861 -0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8467 -1.6035 0.5755 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9139 -1.6614 -1.4674 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6164 -1.3288 -2.1127 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1613 -0.1161 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8768 0.0529 -2.9571 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3031 1.2107 -3.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9626 2.4877 -2.8426 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0804 3.2843 -4.1024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5647 4.4768 -4.2324 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8162 5.1722 -3.1603 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5495 6.4468 -2.8123 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0033 6.6842 -1.6325 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8786 5.7927 -0.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 6.4854 0.7114 C 0 0 0 0 0 0 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41 1 0 41 42 1 0 39 43 2 0 43 44 1 0 43 45 1 0 45 46 1 0 24 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 49 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 55 57 1 0 55 58 1 0 45 37 2 0 1 59 1 0 1 60 1 0 1 61 1 0 2 62 1 0 2 63 1 0 3 64 1 0 4 65 1 0 5 66 1 0 6 67 1 0 7 68 1 0 7 69 1 0 8 70 1 0 9 71 1 0 10 72 1 0 11 73 1 0 12 74 1 0 12 75 1 0 13 76 1 0 14 77 1 0 15 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 29 91 1 0 29 92 1 0 30 93 1 0 30 94 1 0 31 95 1 0 31 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 40107 1 0 40108 1 0 41109 1 0 41110 1 0 42111 1 0 42112 1 0 42113 1 0 44114 1 0 44115 1 0 44116 1 0 46117 1 0 46118 1 0 46119 1 0 47120 1 0 47121 1 0 53122 1 0 53123 1 0 54124 1 0 54125 1 0 56126 1 0 56127 1 0 56128 1 0 57129 1 0 57130 1 0 57131 1 0 58132 1 0 58133 1 0 58134 1 0 M CHG 2 51 -1 55 1 M END