Mol:FL5FFCGS0004
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 33 36 0 0 0 0 0 0 0 0999 V2000 -1.4062 -0.5169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4062 -1.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6918 -1.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0226 -1.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0226 -0.5169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6918 -0.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -1.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4515 -1.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4515 -0.5169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -0.1044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -2.3975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 -0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8938 -0.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 0.7361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8938 1.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 0.7361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1204 -0.1045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6918 -2.5790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 -1.7541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8938 1.9972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3721 1.1457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6918 0.7202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6919 0.2274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8852 -0.2384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1411 0.6573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8852 1.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6919 2.0244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 1.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4027 2.5790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9044 2.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 1.7136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3721 0.2290 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 3 19 1 0 0 0 0 8 20 1 0 0 0 0 16 21 1 0 0 0 0 15 22 1 0 0 0 0 6 23 1 0 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 28 1 0 0 0 0 28 29 1 1 0 0 0 29 24 1 1 0 0 0 28 30 1 0 0 0 0 27 31 1 0 0 0 0 29 32 1 0 0 0 0 24 33 1 0 0 0 0 25 18 1 0 0 0 0 S SKP 5 ID FL5FFCGS0004 FORMULA C21H20O12 EXACTMASS 464.095476104 AVERAGEMASS 464.37629999999996 SMILES c(c23)(OC(c(c4)cc(c(O)c4)O)=C(C3=O)O)c(c(cc2O)OC(O1)C(O)C(O)C(O)C(C)1)O M END
</pre>