Mol:FL1B1CNF0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  25  26 
M  SBL   2  1  29 
M  SMT   2  OCH3 
M  SVB   2 29    0.6438    0.1186 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  23  24 
M  SBL   1  1  27 
M  SMT   1  OCH3 
M  SVB   1 27   -0.8921   -0.6597 
S  SKP  8 
ID	FL1B1CNF0001 
KNApSAcK_ID	C00008074 
NAME	Castillene C 
CAS_RN	126585-62-4 
FORMULA	C20H18O6 
EXACTMASS	354.110338308 
AVERAGEMASS	354.35332 
SMILES	C(Cc(c5)cc(c(c5)4)OCO4)(C(OC)3)(OC)Oc(c32)c(c1cc2)cco1 
M  END