Mol:LBF20203PG02
Copyright: ARM project http://www.metabolome.jp/
26 26 0 0 0 0 0 0 0 0999 V2000 2.0086 0.5105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7233 0.9230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4377 0.5105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7233 1.7480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 0.9230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5795 0.5105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.9230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8494 0.5105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5614 0.9216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 0.4247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0867 0.6796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5716 0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0867 -0.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -0.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5303 -0.9273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8159 -0.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1039 -0.9259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6081 -0.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3201 -0.9259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1451 -0.9259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8596 -0.5134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5716 -0.9244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3407 1.4615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3407 -1.4372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1039 -1.7480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8494 -0.1143 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 2 0 20 21 1 0 21 22 1 0 11 23 1 6 13 24 1 6 17 25 1 6 8 26 2 0
S SKP 6 ID LBF20203PG02 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](C[C@@H]1O)O)CC AUTODRAW FALSE M END
