Mol:FL5FGANS0003

 
 
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  25  26 
M  SBL   3  1  27 
M  SMT   3  OCH3 
M  SVB   3 27   -2.5983   -0.3996 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  23  24 
M  SBL   2  1  25 
M  SMT   2  OCH3 
M  SVB   2 25   -1.0494    1.0455 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  21  22 
M  SBL   1  1  23 
M  SMT   1  OCH3 
M  SVB   1 23    0.5403   -0.6973 
S  SKP  8 
ID	FL5FGANS0003 
KNApSAcK_ID	C00004668 
NAME	Sarothrin 
CAS_RN	57393-71-2 
FORMULA	C18H16O8 
EXACTMASS	360.08451748799996 
AVERAGEMASS	360.31484 
SMILES	c(C(O2)=C(C(c(c3O)c2c(c(c3OC)O)OC)=O)OC)(c1)ccc(O)c1 
M  END