Mol:FL5FAAGS0033
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 40 44 0 0 0 0 0 0 0 0999 V2000 -4.4130 0.7169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4130 -0.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7121 -0.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0111 -0.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0111 0.7169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7121 1.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3101 -0.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6092 -0.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6092 0.7169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3101 1.1216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3101 -1.1283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9085 1.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 0.7090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5204 1.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5204 1.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 2.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9085 1.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7121 -1.3063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1137 1.1215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2346 2.3588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7664 -0.7339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 3.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9727 2.2161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9121 2.4845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8571 2.2161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3456 3.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4063 2.7937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7204 2.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 3.4209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1137 2.8187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0481 -2.2511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7436 -2.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4923 -1.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7436 -0.9451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0481 -0.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -1.3669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1737 -1.3669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1552 -3.0100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5525 -3.4209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2739 -2.2805 0.0000 C 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 3 18 1 0 0 0 0 1 19 1 0 0 0 0 15 20 1 0 0 0 0 8 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 1 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 27 22 1 0 0 0 0 22 28 1 0 0 0 0 27 29 1 0 0 0 0 26 30 1 0 0 0 0 23 20 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 1 0 0 0 36 31 1 1 0 0 0 36 37 1 0 0 0 0 31 38 1 0 0 0 0 32 39 1 0 0 0 0 33 40 1 0 0 0 0 35 21 1 0 0 0 0 S SKP 5 ID FL5FAAGS0033 FORMULA C26H28O14 EXACTMASS 564.147905604 AVERAGEMASS 564.49212 SMILES c(O)(c1)cc(c(C(=O)4)c(OC(=C(OC(C(O)5)OC(C)C(C5O)O)4)c(c3)ccc(c3)OC(C(O)2)OCC(O)C(O)2)1)O M END
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