Mol:FL5FDDNI0002

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  29  30
M  SBL   2  1  31
M  SMT   2  OCH3
M  SVB   2 31   -0.6666   -0.9854
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  27  28
M  SBL   1  1  29
M  SMT   1  OCH3
M  SVB   1 29     0.541    1.7424
S  SKP  8
ID	FL5FDDNI0002
KNApSAcK_ID	C00004932
NAME	Quercetin 3,3'-dimethyl ether 4'-isovalerate
CAS_RN	78516-75-3
FORMULA	C22H22O8
EXACTMASS	414.13146768
AVERAGEMASS	414.40528000000006
SMILES	c(c3O)c(cc(c32)OC(=C(OC)C2=O)c(c1)cc(OC)c(OC(=O)CC(C)C)c1)O
M  END

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