Mol:FL6FCBGS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  27  28 
M  SBL   3  1  30 
M  SMT   3  CH2OH 
M  SVB   3 30   -2.5458   -0.6771 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  31  32 
M  SBL   2  1  34 
M  SMT   2  OCH3 
M  SVB   2 34    2.8202    1.7229 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  29  30 
M  SBL   1  1  32 
M  SMT   1  OCH3 
M  SVB   1 32   -1.6931    1.1384 
S  SKP  8 
ID	FL6FCBGS0001 
KNApSAcK_ID	C00008772 
NAME	Dichotosin 
CAS_RN	97399-72-9 
FORMULA	C23H28O9 
EXACTMASS	448.17333249399996 
AVERAGEMASS	448.46302000000003 
SMILES	O(C)c(c2)cc(c(C3)c(O[C@H](c(c4)ccc(c4)OC)C3)2)O[C@@H]([C@@H](O)1)OC(CO)[C@@H]([C@@H]1O)O 
M  END