Mol:FL5FFAGS0004
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -2.1681 -0.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1681 -1.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4536 -2.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7392 -1.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7392 -0.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4536 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0247 -2.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6897 -1.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6897 -0.9209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0247 -0.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0247 -2.8016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4039 -0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1321 -0.9290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 0.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1321 0.7527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4039 0.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8823 -0.5085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4127 -2.1389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4536 -2.9831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4822 0.8678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8855 2.7062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2509 1.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5662 1.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1641 0.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9541 1.3939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6392 1.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4159 2.9831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4822 2.5419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5995 0.5712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4536 0.3163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 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 1 2 0 0 0 0 4 7 1 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 5 1 0 0 0 0 7 11 2 0 0 0 0 9 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 12 1 0 0 0 0 1 18 1 0 0 0 0 8 19 1 0 0 0 0 3 20 1 0 0 0 0 21 15 1 0 0 0 0 22 23 1 1 0 0 0 23 24 1 1 0 0 0 25 24 1 1 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 22 28 1 0 0 0 0 23 29 1 0 0 0 0 24 30 1 0 0 0 0 6 31 1 0 0 0 0 31 25 1 0 0 0 0 S SKP 5 ID FL5FFAGS0004 FORMULA C20H18O11 EXACTMASS 434.084911418 AVERAGEMASS 434.35032 SMILES c(c4)c(ccc(O)4)C(O1)=C(C(c(c2O)c1c(OC(O3)C(O)C(C(O)C3)O)c(O)c2)=O)O M END
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