HMDB0289204 RDKit 3D PC(18:3(9,11,15)-OH(13)/DiMe(13,5)) 150150 0 0 0 0 0 0 0 0999 V2000 3.8012 -3.8361 -1.2971 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 -4.3455 -2.2127 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3997 -3.3163 -3.1486 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -3.5069 -4.4515 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7607 -2.5987 -5.5039 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3984 -1.3343 -5.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7711 -0.6342 -6.2206 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4441 -0.4231 -4.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7095 0.8520 -4.1783 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7776 1.7824 -3.4977 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0473 3.0390 -3.3287 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 4.1574 -2.7485 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1277 4.2813 -2.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7976 3.5490 -0.8529 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5591 2.1189 -0.7401 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3502 1.5138 -1.3263 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0224 1.5683 -2.7517 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3422 0.8619 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -0.5271 -2.4909 C 0 0 0 0 0 0 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64 1 0 1 65 1 0 2 66 1 0 2 67 1 0 3 68 1 0 4 69 1 0 5 70 1 0 5 71 1 0 6 72 1 0 7 73 1 0 8 74 1 0 9 75 1 0 10 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 17 88 1 0 17 89 1 0 18 90 1 0 18 91 1 0 22 92 1 0 22 93 1 0 23 94 1 1 24 95 1 0 24 96 1 0 30 97 1 0 30 98 1 0 31 99 1 0 31100 1 0 33101 1 0 33102 1 0 33103 1 0 34104 1 0 34105 1 0 34106 1 0 35107 1 0 35108 1 0 35109 1 0 39110 1 0 39111 1 0 40112 1 0 40113 1 0 41114 1 0 41115 1 0 42116 1 0 42117 1 0 43118 1 0 43119 1 0 44120 1 0 44121 1 0 45122 1 0 45123 1 0 46124 1 0 46125 1 0 47126 1 0 47127 1 0 48128 1 0 48129 1 0 49130 1 0 49131 1 0 50132 1 0 50133 1 0 54134 1 0 54135 1 0 55136 1 0 55137 1 0 56138 1 0 56139 1 0 57140 1 0 57141 1 0 58142 1 0 58143 1 0 58144 1 0 60145 1 0 60146 1 0 60147 1 0 62148 1 0 62149 1 0 62150 1 0 M CHG 2 28 -1 32 1 M END