Mol:LBF20406CV17
Copyright: ARM project http://www.metabolome.jp/
26 26 0 0 0 0 0 0 0 0999 V2000 -0.7823 0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4943 0.7023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2349 0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2349 -0.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0196 -0.7887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5045 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0196 0.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4346 -1.1752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0427 0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7201 -0.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1049 -0.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8193 -1.1752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5313 -0.7641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2433 -1.1752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9553 -0.7641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6673 -1.1752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2745 1.3307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4484 -1.3307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7572 0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4716 0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1861 0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9006 0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 0.7037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3295 0.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9006 -0.3212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3295 -0.1214 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 2 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 3 1 0 4 8 1 0 1 9 2 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 7 17 2 0 4 18 1 6 9 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 22 25 2 0 6 26 1 0
S SKP 6 ID LBF20406CV17 FORMULA C21H29IO4 EXACTMASS 472.111052416 AVERAGEMASS 472.35732999999993 SMILES C(C(=CC=CCCCC(OC)=O)1)(C(=C[C@@](O)1CC=CCCCCC)I)=O AUTODRAW FALSE M END
