Mol:FL3FAACS0024

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M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  39  40
M  SBL   1  1  44
M  SMT   1 ^ CH2OH
M  SBV   1  44    0.6759   -0.6448
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  41  42
M  SBL   2  1  46
M  SMT   2 ^ CH2OH
M  SBV   2  46    0.8268   -0.3737
S  SKP  5
ID	FL3FAACS0024
FORMULA	C27H30O15
EXACTMASS	594.15847029
AVERAGEMASS	594.5181
SMILES	c(c5)(ccc(c5)C(=C4)Oc(c(C4=O)1)cc(O)c(C(C2OC(C(O)3)OC(CO)C(C(O)3)O)OC(C(C2O)O)CO)c1O)O
M  END

</pre>

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