Mol:LBF20207PG78
(Redirected from Mol:LBF25307PG01)
Copyright: ARM project http://www.metabolome.jp/
33 33 0 0 0 0 0 0 0 0999 V2000 -0.5939 1.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3086 1.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0516 1.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0516 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8391 -0.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3257 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8391 1.2886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5135 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2339 1.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9508 1.4467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6653 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3797 1.4467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8085 1.4467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9155 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6299 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3444 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0561 -0.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7682 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0941 2.0731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -0.8356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 0.2092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -1.1399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8085 -1.2481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8085 -2.0731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5229 -0.8356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5229 1.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3444 0.9630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6299 0.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9154 0.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6299 0.0510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 6 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 3 1 0 4 8 1 1 8 9 2 0 9 10 1 0 1 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 10 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 7 22 1 6 5 23 1 6 15 24 2 0 10 25 1 6 23 26 1 0 26 27 2 0 26 28 1 0 16 29 1 0 19 30 1 0 30 31 1 0 31 32 1 0 31 33 2 0
S SKP 6 ID LBF20207PG78 FORMULA C25H40O8 EXACTMASS 468.27231825599995 AVERAGEMASS 468.5803 SMILES CC(=O)OC(CC[C@@H](C=C[C@H]([C@H]1CC=CCCCC(OC)=O)[C@H](OC(C)=O)C[C@@H]1O)O)CC AUTODRAW FALSE M END
