Mol:LBF20207PG73
Copyright: ARM project http://www.metabolome.jp/
28 28 0 0 0 0 0 0 0 0999 V2000 -0.2367 1.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9514 1.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6944 1.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6944 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4819 -0.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9685 0.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4819 1.2886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8708 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1563 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5582 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 1.4467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0225 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7369 1.4467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4512 1.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1657 1.4467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2727 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9871 -0.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7016 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4133 -0.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1254 0.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7369 2.0731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7368 -0.8356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4512 0.2092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5582 -1.1399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4513 -1.2481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4513 -2.0731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1657 -0.8356 0.0000 C 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
S SKP 6 ID LBF20207PG73 FORMULA C22H36O6 EXACTMASS 396.251188884 AVERAGEMASS 396.51764000000003 SMILES [C@@H]([C@@H]1C=C[C@H](CCCCC)O)(C[C@@H]([C@@H]1CC=CCCCC(O)=O)O)OC(C)=O AUTODRAW FALSE M END
