Mol:FL1CG9NI0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 29 30  0  0  0  0  0  0  0  0999 V2000 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  26  27 
M  SBL   1  1  27 
M  SMT   1 ^OCH3 
M  SBV   1 27   -6.6300    2.8635 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  28  29 
M  SBL   2  1  29 
M  SMT   2 OCH3 
M  SBV   2 29   -5.3630    3.0890 
S  SKP  8 
ID	FL1CG9NI0003 
KNApSAcK_ID	C00007119 
NAME	Valafolone 
CAS_RN	129724-41-0 
FORMULA	C22H24O7 
EXACTMASS	400.152203122 
AVERAGEMASS	400.42176000000006 
SMILES	C(C(=O)c(c(OC)2)c(c(c(O)c2OC(CC(C)C)=O)OC)O)=Cc(c1)cccc1 
M  END