Mol:FL5FECGL0002

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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  44  45
M  SBL   2  1  48
M  SMT   2  CH2OH
M  SVB   2 48   -4.1564    0.2911
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  42  43
M  SBL   1  1  46
M  SMT   1  CH2OH
M  SVB   1 46    4.2076   -1.4068
S  SKP  8
ID	FL5FECGL0002
KNApSAcK_ID	C00005634
NAME	Quercetagetin 3,7-diglucoside
CAS_RN	65180-48-5
FORMULA	C27H30O18
EXACTMASS	642.143214156
AVERAGEMASS	642.5163
SMILES	C([C@H]([C@@H]5O)O[C@H](C(O)C(O)5)OC(C4=O)=C(Oc(c34)cc(c(c(O)3)O)O[C@@H]([C@H]2O)OC(CO)[C@H](O)[C@@H]2O)c(c1)ccc(O)c(O)1)O
M  END

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