Mol:FL7AAIGL0023

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FL7AAIGL0023.png 

 
 
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M  CHG  1  10   1 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  63  64 
M  SBL   1  1  70 
M  SMT   1  OCH3 
M  SBV   1  70    0.0000   -0.7676 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  65  66 
M  SBL   2  1  72 
M  SMT   2 ^ CH2OH 
M  SBV   2  72    0.5974   -0.5852 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  67  68 
M  SBL   3  1  74 
M  SMT   3  OCH3 
M  SBV   3  74   -0.7324    0.4229 
S  SKP  5 
ID	FL7AAIGL0023 
FORMULA	C44H51O24 
EXACTMASS	963.27702756 
AVERAGEMASS	963.86134 
SMILES	c(c6)(O)cc(OC(O7)C(O)C(O)C(C7CO)O)c(c56)cc(c([o+1]5)c(c4)cc(OC)c(O)c4OC)OC(O1)C(C(O)C(C1COC(O3)C(C(O)C(C3C)OC(=O)C=Cc(c2)cc(O)c(c2)O)O)O)O 
M  END
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