Mol:FL3FCDCS0002

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  33  34
M  SBL   3  1  36
M  SMT   3  CH2OH
M  SVB   3 36   -2.8345   -0.4538
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  31  32
M  SBL   2  1  34
M  SMT   2  OCH3
M  SVB   2 34   -1.1371    0.4536
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  29  30
M  SBL   1  1  32
M  SMT   1  OCH3
M  SVB   1 32    3.0043     1.856
S  SKP  8
ID	FL3FCDCS0002
KNApSAcK_ID	C00006142
NAME	Isoorientin 7,3'-dimethyl ether;7,3'-Di-O-methylisoorientin;6-beta-D-Glucopyranosyl-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
CAS_RN	74198-15-5
FORMULA	C23H24O11
EXACTMASS	476.13186161
AVERAGEMASS	476.43006
SMILES	c(c4O)(cc(cc4)C(=C3)Oc(c1)c(C3=O)c(O)c([C@H](O2)[C@@H](O)[C@H]([C@H](C2CO)O)O)c1OC)OC
M  END

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