Mol:FL3FF8GS0005

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   5 SUP
M  SLB  1   5   5
M  SAL   5  2  36  37
M  SBL   5  1  39
M  SMT   5  CH2OH
M  SVB   5 39   -2.2205   -0.4431
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  34  35
M  SBL   4  1  37
M  SMT   4  OCH3
M  SVB   4 37    0.1872    1.4064
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  32  33
M  SBL   3  1  35
M  SMT   3  OCH3
M  SVB   3 35    1.3952    2.0056
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  30  31
M  SBL   2  1  33
M  SMT   2  OCH3
M  SVB   2 33   -0.8437    1.2837
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  28  29
M  SBL   1  1  31
M  SMT   1  OCH3
M  SVB   1 31    2.4825    2.2208
S  SKP  8
ID	FL3FF8GS0005
KNApSAcK_ID	C00004450
NAME	5-Hydroxy-7,8,2',3'-tetramethoxyflavone 5-glucoside
CAS_RN	113963-40-9
FORMULA	C25H28O12
EXACTMASS	520.15807636
AVERAGEMASS	520.48262
SMILES	c(c4OC)(c(O1)c(c(c4)O[C@@H]([C@H]3O)OC(CO)[C@H](O)[C@@H]3O)C(C=C(c(c2)c(c(cc2)OC)OC)1)=O)OC
M  END

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