Mol:FLIAECGS0006

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  29  30
M  SBL   4  1  32
M  SMT   4  CH2OH
M  SVB   4 32   -3.4743    1.5785
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  35  36
M  SBL   3  1  38
M  SMT   3  OCH3
M  SVB   3 38    3.4146   -0.0048
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  33  34
M  SBL   2  1  36
M  SMT   2  OCH3
M  SVB   2 36    -1.796    0.1255
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  31  32
M  SBL   1  1  34
M  SMT   1  OCH3
M  SVB   1 34    3.0573    -1.166
S  SKP  8
ID	FLIAECGS0006
KNApSAcK_ID	C00010149
NAME	Junipegenin B 7-O-glucoside
CAS_RN	86849-69-6
FORMULA	C24H26O12
EXACTMASS	506.142426296
AVERAGEMASS	506.45604
SMILES	c(c1)c(c(OC)cc1C(C(=O)4)=COc(c42)cc(O[C@@H]([C@H]3O)OC(CO)[C@H](O)[C@@H]3O)c(c2O)OC)OC
M  END

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