Mol:FL5FAAGM0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 36  0  0  0  0  0  0  0  0999 V2000 
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    0.0582   -5.5174    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0818   -5.3369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2219   -1.5103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3557   -2.5013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
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  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
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  7 11  2  0  0  0  0 
  9 12  1  0  0  0  0 
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 23 22  1  1  0  0  0 
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 15 28  1  0  0  0  0 
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  1 30  1  0  0  0  0 
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 22 32  1  0  0  0  0 
 32 33  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  32  33 
M  SBL   1  1  35 
M  SMT   1  CH2OH 
M  SVB   1 35    3.2219   -1.5103 
S  SKP  8 
ID	FL5FAAGM0001 
KNApSAcK_ID	C00005801 
NAME	6-C-Methylkaempferol 3-glucoside 
CAS_RN	68116-36-9 
FORMULA	C22H22O11 
EXACTMASS	462.116211546 
AVERAGEMASS	462.40348000000006 
SMILES	c(c4O)(c(O)c(c(c4)2)C(=O)C(=C(c(c3)ccc(c3)O)O2)O[C@H](O1)C(O)C([C@H]([C@@H](CO)1)O)O)C 
M  END