Mol:FL5FFCNS0008

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 27  0  0  0  0  0  0  0  0999 V2000 
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    1.9523    0.1843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9523    0.8390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853    1.1663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.6687    1.7424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  24  25 
M  SBL   2  1  26 
M  SMT   2  OCH3 
M  SVB   2 26    1.6687    1.7424 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  22  23 
M  SBL   1  1  24 
M  SMT   1  OCH3 
M  SVB   1 24    0.4611   -0.9854 
S  SKP  8 
ID	FL5FFCNS0008 
KNApSAcK_ID	C00004728 
NAME	Gossypetin 3,3'-dimethyl ether 
CAS_RN	96887-24-0 
FORMULA	C17H14O8 
EXACTMASS	346.068867424 
AVERAGEMASS	346.28826 
SMILES	COc(c(O)3)cc(cc3)C(O1)=C(OC)C(=O)c(c(O)2)c1c(O)c(O)c2 
M  END