Mol:FLIFHXNS0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 28 31  0  0  0  0  0  0  0  0999 V2000 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  27  28 
M  SBL   3  1  30 
M  SMT   3  OCH3 
M  SVB   3 30   -2.6398    1.3978 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  25  26 
M  SBL   2  1  28 
M  SMT   2  OCH3 
M  SVB   2 28    0.6762   -1.3861 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  23  24 
M  SBL   1  1  26 
M  SMT   1  OCH3 
M  SVB   1 26    1.9253   -1.0774 
S  SKP  8 
ID	FLIFHXNS0002 
KNApSAcK_ID	C00009581 
NAME	Clitoriacetal 
CAS_RN	64461-44-5 
FORMULA	C19H18O9 
EXACTMASS	390.095082174 
AVERAGEMASS	390.34082 
SMILES	c(c4OC)(OC)cc(O1)c(c4)C(C3=O)(C(Oc(c23)cc(OC)cc2O)C1O)O 
M  END