Mol:LBPR01070215
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 44 43 0 0 0 0 0 0 0 0999 V2000 -11.2116 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4883 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7649 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0416 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3183 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5949 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8716 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1483 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7016 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9783 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5316 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8083 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3617 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3617 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8083 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5316 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9783 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7016 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1483 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8716 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5949 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3183 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0416 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7649 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4883 -0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5949 1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7016 1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8083 1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8083 -1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7016 -1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5949 -1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2116 0.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4883 1.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4883 -1.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2116 0.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2029 -0.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7649 -1.0342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7649 1.0342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 6 32 1 0 0 0 0 10 33 1 0 0 0 0 14 34 1 0 0 0 0 19 35 1 0 0 0 0 23 36 1 0 0 0 0 27 37 1 0 0 0 0 31 38 1 0 0 0 0 2 39 1 0 0 0 0 31 40 1 0 0 0 0 2 41 1 0 0 0 0 31 42 1 0 0 0 0 3 43 2 0 0 0 0 30 44 2 0 0 0 0 S SKP 5 ID LBPR01070215 FORMULA C40H52O4 EXACTMASS 596.386560152 AVERAGEMASS 596.83848 SMILES C(C(C)=CC=CC(C)=CC=CC(=CC=CC=C(C=CC=C(C)C=CC=C(C=CC(=O)C(C)(C)O)C)C)C)=CC(=O)C(C)(C)O M END
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