Mol:FL2FECNS0002

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FL2FECNS0002.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 27  0  0  0  0  0  0  0  0999 V2000 
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   -2.3202    0.4474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8202    1.3134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
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  1 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  24  25 
M  SBL   3  1  26 
M  SMT   3  OCH3 
M  SVB   3 26   -2.3202    0.4474 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  22  23 
M  SBL   2  1  24 
M  SMT   2  OCH3 
M  SVB   2 24    1.6687    1.7079 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  20  21 
M  SBL   1  1  22 
M  SMT   1  OCH3 
M  SVB   1 22   -1.8431   -1.2954 
S  SKP  8 
ID	FL2FECNS0002 
KNApSAcK_ID	C00008309 
NAME	Agestricin D 
CAS_RN	85563-76-4 
FORMULA	C18H18O7 
EXACTMASS	346.10525293 
AVERAGEMASS	346.33132 
SMILES	O(C(c(c3)cc(OC)c(O)c3)2)c(c(C(=O)C2)1)cc(c(c1OC)O)OC 
M  END
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