Mol:FL3FACCS0038
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -1.8537 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8537 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1391 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4246 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4246 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1391 0.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2899 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0044 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0044 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2899 0.2446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1391 -2.2302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7244 0.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4036 -0.1182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0827 0.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0827 1.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4036 1.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7244 1.0582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7618 1.4502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2899 -2.2345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6857 0.8584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8888 1.0168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1679 0.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5985 1.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3116 1.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7618 1.4924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4199 1.0507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5818 2.0777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7933 1.9943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5679 0.2444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4036 2.2345 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 3 11 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 9 12 1 0 0 0 0 15 18 1 0 0 0 0 7 19 2 0 0 0 0 20 21 1 1 0 0 0 21 22 1 1 0 0 0 23 22 1 1 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 20 1 0 0 0 0 20 26 1 0 0 0 0 21 27 1 0 0 0 0 24 28 1 0 0 0 0 25 29 1 0 0 0 0 6 23 1 0 0 0 0 1 30 1 0 0 0 0 16 31 1 0 0 0 0 S SKP 5 ID FL3FACCS0038 FORMULA C21H20O10 EXACTMASS 432.10564686 AVERAGEMASS 432.37749999999994 SMILES c(O)(c2)c(C(=O)4)c(OC(=C4)c(c3)cc(c(O)c3)O)c(c(O)2)C(C(O)1)OC(C)C(O)C1O M END
</pre>