Mol:FLIAEGGS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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  2 10  1  0  0  0  0 
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  6 12  2  0  0  0  0 
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M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  34  35 
M  SBL   4  1  37 
M  SMT   4  CH2OH 
M  SVB   4 37   -3.2957    1.7141 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  36  37 
M  SBL   3  1  39 
M  SMT   3  OCH3 
M  SVB   3 39    2.0517   -1.3016 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  32  33 
M  SBL   2  1  35 
M  SMT   2  OCH3 
M  SVB   2 35    3.2359   -1.0304 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  30  31 
M  SBL   1  1  33 
M  SMT   1  OCH3 
M  SVB   1 33   -1.6173    0.2611 
S  SKP  8 
ID	FLIAEGGS0001 
KNApSAcK_ID	C00010137 
NAME	Irigenin 7-O-glucoside;Iridin 
CAS_RN	491-74-7 
FORMULA	C24H26O13 
EXACTMASS	522.137340918 
AVERAGEMASS	522.45544 
SMILES	[C@@H](Oc(c2OC)cc(O4)c(C(=O)C(=C4)c(c3)cc(c(OC)c(OC)3)O)c2O)([C@H]1O)OC(CO)[C@H](O)[C@@H]1O 
M  END