Mol:FL5FAAGL0104

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FL5FAAGL0104.png 

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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  60  61
M  SBL   1  1  67
M  SMT   1  CH2OH
M  SBV   1  67   -0.7480    0.1027
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  62  63
M  SBL   2  1  69
M  SMT   2 ^ CH2OH
M  SBV   2  69    0.4523   -0.4085
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  64  65
M  SBL   3  1  71
M  SMT   3  OCH3
M  SBV   3  71   -0.7136   -0.4120
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  66  67
M  SBL   4  1  73
M  SMT   4  CH2OH
M  SBV   4  73   -0.7081    0.1040
S  SKP  5
ID	FL5FAAGL0104
FORMULA	C43H48O24
EXACTMASS	948.253552464
AVERAGEMASS	948.82682
SMILES	C(OC(=C(c(c6)ccc(OC(O7)C(O)C(C(C(CO)7)O)O)c6)5)C(=O)c(c2O5)c(cc(OC(C(OC(C=Cc(c4)cc(c(O)c4)OC)=O)3)OC(C(O)C3O)CO)c2)O)(O1)C(O)C(O)C(C(CO)1)O
M  END

</pre>

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