Mol:LBF20107PG02
Copyright: ARM project http://www.metabolome.jp/
26 26 0 0 0 0 0 0 0 0999 V2000 2.0092 0.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7239 0.9502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4383 0.5377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7239 1.7753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 0.9502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 0.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1345 0.9502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8489 0.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 0.9488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2158 0.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0004 0.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4853 0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0004 -0.6567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2158 -0.4018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5013 -0.9574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7867 -0.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0747 -0.9559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6373 -0.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3493 -0.9559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0613 -0.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7733 -0.9559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4853 -0.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2553 1.4629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0747 -1.7753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2544 -1.4387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8489 -0.0871 0.0000 O 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 1 0 10 9 1 6 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 10 1 0 14 15 1 1 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 11 23 2 0 17 24 1 6 13 25 1 6 8 26 2 0
S SKP 6 ID LBF20107PG02 FORMULA C20H32O6 EXACTMASS 368.219888756 AVERAGEMASS 368.46448 SMILES C(CC[C@@H](O)C=C[C@H]([C@@H](CC(=O)CCCCC(O)=O)1)[C@@H](CC1=O)O)CC AUTODRAW FALSE M END
