Mol:FL63CCNS0001

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Copyright: ARM project http://www.metabolome.jp/
 22 24  0  0  0  0  0  0  0  0999 V2000
    1.4194    0.6064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7049    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0057    0.6041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7162    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7162   -0.6267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0057   -1.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7049   -0.6267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4268    0.6041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1374    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1374   -0.6267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4268   -1.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4268   -1.8619    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4194   -1.0392    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8519    0.6064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5664    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1443    0.1878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8692    0.6064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8692    1.4434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1443    1.8619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4194    1.4434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4557    1.7820    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5664    0.2038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  2  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  5  1  0  0  0  0
 11 12  1  0  0  0  0
  9 14  1  0  0  0  0
  7 13  1  1  0  0  0
 14 15  1  0  0  0  0
  1 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20  1  1  0  0  0  0
 18 21  1  0  0  0  0
 17 22  1  0  0  0  0
S  SKP  8
ID	FL63CCNS0001
KNApSAcK_ID	C00013258
NAME	Catechin-7-methyl ether
CAS_RN	-
FORMULA	C16H16O6
EXACTMASS	304.094688244
AVERAGEMASS	304.29463999999996
SMILES	COc(c1)cc(O2)c(CC(O)C2c(c3)cc(O)c(O)c3)c(O)1
M  END

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