Mol:FL7AAAGL0049

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FL7AAAGL0049.png

 
 
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M  CHG  1  10   1 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  71  72 
M  SBL   1  1  79 
M  SMT   1 ^ CH2OH 
M  SBV   1  79    0.0333    0.7016 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  73  74 
M  SBL   2  1  81 
M  SMT   2 ^ CH2OH 
M  SBV   2  81    0.4058   -0.6957 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  75  76 
M  SBL   3  1  83 
M  SMT   3 ^ CH2OH 
M  SBV   3  83    0.4977   -0.5767 
S  SKP  5 
ID	FL7AAAGL0049 
FORMULA	C48H57O28 
EXACTMASS	1081.30363624 
AVERAGEMASS	1081.94938 
SMILES	OC(C8O)C(OC(C(O)8)OC(C3O)C(Oc(c7)c([o+1]c(c75)cc(O)cc5OC(C(O)6)OC(C(O)C6O)CO)c(c4)ccc(c4)O)OC(C3O)CO)COC(=O)C=Cc(c1)ccc(c1OC(O2)C(C(C(O)C2CO)O)O)O 
M  END
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