Mol:FL3FACDS0024

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  49  50 
M  SBL   1  1  54 
M  SMT   1  CH2OH 
M  SBV   1  54   -0.2857    1.0663 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  51  52 
M  SBL   2  1  57 
M  SMT   2 ^ CH2OH 
M  SBV   2  57    0.4744   -0.4744 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  53  54 
M  SBL   3  1  59 
M  SMT   3  CH2OH 
M  SBV   3  59   -0.4579   -0.4579 
S  SKP  5 
ID	FL3FACDS0024 
FORMULA	C33H40O21 
EXACTMASS	772.206208342 
AVERAGEMASS	772.6581 
SMILES	c(c1C(C(O)6)OC(C(O)C6O)CO)(O3)c(C(C=C(c(c4)cc(OC(O5)C(C(O)C(O)C5CO)O)c(O)c4)3)=O)c(c(C(O2)C(O)C(O)C(O)C2CO)c1O)O 
M  END