Mol:FLIAAEGS0002

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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  38  39
M  SBL   2  1  41
M  SMT   2  OCH3
M  SVB   2 41    3.2359   -1.8564
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  3  33  35  34
M  SBL   1  1  36
M  SMT   1  COOH
M  SVB   1 36   -1.9798     1.873
S  SKP  8
ID	FLIAAEGS0002
KNApSAcK_ID	C00010144
NAME	Pratensein 7-O-(6''-malonylglucoside)
CAS_RN	92632-65-0
FORMULA	C25H24O14
EXACTMASS	548.116605476
AVERAGEMASS	548.44966
SMILES	O=C(CC(O)=O)OCC([C@H](O)4)O[C@H]([C@H]([C@H]4O)O)Oc(c1)cc(O2)c(C(=O)C(c(c3)cc(c(c3)OC)O)=C2)c1O
M  END

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