Mol:LBF20406LT12
Copyright: ARM project http://www.metabolome.jp/
27 26 0 0 0 0 0 0 0 0999 V2000 3.2617 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9764 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6908 -0.0007 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9764 1.2368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8326 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1206 0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4086 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4164 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1309 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8428 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5548 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2668 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9788 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6908 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6908 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9763 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2619 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5474 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8329 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1185 -1.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1206 1.2325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9788 1.2310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -1.2354 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1034 -0.5314 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.3424 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 0 1 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 7 23 1 1 14 24 1 1 22 25 1 0 22 26 1 0 22 27 1 0
S SKP 6 ID LBF20406LT12 FORMULA C20H29F3O4 EXACTMASS 390.201794016 AVERAGEMASS 390.4370696 SMILES C(F)(F)(F)CCCCC=CC[C@H](C=CC=CC=C[C@H](CCCC(O)=O)O)O AUTODRAW FALSE M END
