Mol:FLIFWYNS0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 29 32  0  0  0  0  0  0  0  0999 V2000 
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  4  5  2  0  0  0  0 
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  6  1  2  0  0  0  0 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  28  29 
M  SBL   3  1  31 
M  SMT   3  OCH3 
M  SVB   3 31   -2.6398    1.1503 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  23  24 
M  SBL   2  1  26 
M  SMT   2  OCH3 
M  SVB   2 26    0.6762   -1.6336 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  21  22 
M  SBL   1  1  24 
M  SMT   1  OCH3 
M  SVB   1 24    1.9253   -1.3249 
S  SKP  8 
ID	FLIFWYNS0003 
KNApSAcK_ID	C00009597 
NAME	Stemonacetal 
CAS_RN	54357-81-2 
FORMULA	C21H20O8 
EXACTMASS	400.11581761599996 
AVERAGEMASS	400.3787 
SMILES	c(c41)(C(C(c23)=C(O4)C(Oc2cc(OC)c(OC)c3)OCC)=O)c(cc(OC)c1)O 
M  END