Mol:FL4DA8NS0007

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Copyright: ARM project http://www.metabolome.jp/
 24 26  0  0  0  0  0  0  0  0999 V2000
   -2.1353    0.1544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4226    0.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4153   -1.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7027   -0.6643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7063    0.1607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7262   -0.6580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7226    0.1670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0063    0.5764    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3764    0.5479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0924    0.1381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8053    0.5534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8021    1.3784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0860    1.7881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3732    1.3728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0147   -1.7169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3041   -0.9916    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3892    0.1438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3892    0.2162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0924   -0.5488    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7801   -0.9459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  2  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  6  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  4 18  1  0  0  0  0
  1 19  1  0  0  0  0
  8 20  1  0  0  0  0
 19 21  1  0  0  0  0
 13 22  1  0  0  0  0
 12 23  1  0  0  0  0
 23 24  1  0  0  0  0
S  SKP  8
ID	FL4DA8NS0007
KNApSAcK_ID	C00014367
NAME	3,5,3'-Trihydroxy-7,2'-dimethoxyflavanone
CAS_RN	188440-69-9
FORMULA	C17H16O7
EXACTMASS	332.089602866
AVERAGEMASS	332.30474
SMILES	COc(c3)cc(O1)c(c(O)3)C(=O)C(O)C1c(c2)c(OC)c(O)cc2
M  END

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