Mol:FL63CENS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 25  0  0  0  0  0  0  0  0999 V2000 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  22  23 
M  SBL   2  1  24 
M  SMT   2  OCH3 
M  SVB   2 24     1.955    1.0728 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  20  21 
M  SBL   1  1  22 
M  SMT   1  OCH3 
M  SVB   1 22   -2.6695    0.4715 
S  SKP  8 
ID	FL63CENS0001 
KNApSAcK_ID	C00008812 
NAME	Catechin 7,4'-dimethyl ether 
CAS_RN	105330-66-3 
FORMULA	C17H18O6 
EXACTMASS	318.110338308 
AVERAGEMASS	318.32122 
SMILES	COc(c1)cc(O2)c(C[C@H](O)[C@H]2c(c3)cc(O)c(OC)c3)c(O)1 
M  END