Mol:FL7AAIGL0022

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FL7AAIGL0022.png 

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  CHG  1  10   1 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  62  63 
M  SBL   1  1  69 
M  SMT   1 ^ CH2OH 
M  SBV   1  69    0.6300   -0.6300 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  64  65 
M  SBL   2  1  71 
M  SMT   2  OCH3 
M  SBV   2  71   -0.6929    0.4000 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  66  67 
M  SBL   3  1  73 
M  SMT   3  OCH3 
M  SBV   3  73    0.0000   -0.7828 
S  SKP  5 
ID	FL7AAIGL0022 
FORMULA	C44H51O23 
EXACTMASS	947.282112938 
AVERAGEMASS	947.86194 
SMILES	OC(C(OC(=O)C=Cc(c7)ccc(O)c7)6)C(C(OC6C)OCC(C(O)5)OC(C(C5O)O)Oc(c2c(c4)cc(OC)c(O)c4OC)cc(c(OC(O3)C(O)C(O)C(C3CO)O)1)c([o+1]2)cc(O)c1)O 
M  END
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