Mol:LBF20303PG05
Copyright: ARM project http://www.metabolome.jp/
25 25 0 0 0 0 0 0 0 0999 V2000 -0.8485 0.6998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 1.1123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3348 0.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3348 -0.2716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1222 -0.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6086 0.1423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1222 0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5031 -0.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7886 -0.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0743 -0.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0208 0.6998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6961 1.1137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4106 0.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1249 1.1137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8394 0.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5537 1.1137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8394 0.0132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6402 -0.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3547 -0.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 1.5967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0743 -1.5967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1797 -0.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8942 -0.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6086 -0.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3771 -1.3120 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 15 17 2 0 10 18 1 0 18 19 1 0 7 20 1 6 10 21 1 6 19 22 2 0 22 23 1 0 23 24 1 0 5 25 2 0
S SKP 6 ID LBF20403PG05 FORMULA C20H30O5 EXACTMASS 350.20932407 AVERAGEMASS 350.4492 SMILES C(=CC[C@@H](O)C=C[C@H]([C@H]1CC=CCCCC(O)=O)C(C[C@@H]1O)=O)CC AUTODRAW FALSE M END
