Mol:FLIFWXNP0003

 
 
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  29  30 
M  SBL   2  1  33 
M  SMT   2  OCH3 
M  SVB   2 33    2.3331   -1.2885 
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  SVB   1 31    1.0839   -1.5972 
S  SKP  8 
ID	FLIFWXNP0003 
KNApSAcK_ID	C00009605 
NAME	Dehydrotoxicarol;7a,13a-Didehydrotoxicarol 
CAS_RN	59086-93-0 
FORMULA	C23H20O7 
EXACTMASS	408.120902994 
AVERAGEMASS	408.40070000000003 
SMILES	c(O2)(c1C(C5=O)=C(Oc(c45)c(c3cc4O)C=CC(O3)(C)C)C2)cc(OC)c(c1)OC 
M  END