Mol:FL4DECNS0001

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FL4DECNS0001.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 27 29  0  0  0  0  0  0  0  0999 V2000 
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    2.4819    1.3047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4245    1.9152    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  1  2  2  0  0  0  0 
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  3  4  2  0  0  0  0 
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  5  6  2  0  0  0  0 
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  8  9  1  0  0  0  0 
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  2 12  1  0  0  0  0 
  6 13  1  0  0  0  0 
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  1 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  26  27 
M  SBL   1  1  28 
M  SMT   1  OCH3 
M  SVB   1 28   -2.4819    -0.346 
S  SKP  8 
ID	FL4DECNS0001 
KNApSAcK_ID	C00008746 
NAME	3,5,7,3',4'-Pentahydroxy-6-methoxyflavanone 3-acetate 
CAS_RN	130926-70-4 
FORMULA	C18H16O9 
EXACTMASS	376.07943210999997 
AVERAGEMASS	376.31424 
SMILES	c(c3OC)(O)cc(O1)c(c3O)C(C([C@H]1c(c2)cc(O)c(O)c2)OC(C)=O)=O 
M  END
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