Mol:FLIA1LNP0004

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  27  28 
M  SBL   1  1  31 
M  SMT   1 ^OCH3 
M  SBV   1 31   -6.6764    3.0995 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  29  30 
M  SBL   2  1  33 
M  SMT   2 OCH3 
M  SBV   2 33   -5.3678    3.3731 
S  SKP  8 
ID	FLIA1LNP0004 
KNApSAcK_ID	C00009445 
NAME	Ferrugone 
CAS_RN	7731-08-0 
FORMULA	C23H20O7 
EXACTMASS	408.120902994 
AVERAGEMASS	408.40070000000003 
SMILES	O(C=3)c(c(C(C3c(c5OC)cc(OC)c(c54)OCO4)=O)2)c(C=1)c(cc2)OC(C1)(C)C 
M  END