Mol:FL7AACGL0082

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FL7AACGL0082.png 

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Copyright: ARM project http://www.metabolome.jp/
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M  CHG  1  10   1
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  94  95
M  SBL   1  1 104
M  SMT   1  CH2OH
M  SBV   1 104   -0.7229   -0.0622
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  96  97
M  SBL   2  1 106
M  SMT   2 ^ CH2OH
M  SBV   2 106    0.5141   -0.4778
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  3  98  99 100
M  SBL   3  1 109
M  SMT   3 ^ COOH
M  SBV   3 109    0.7482   -0.4318
S  SKP  5
ID	FL7AACGL0082
FORMULA	C62H71O38
EXACTMASS	1423.3623329079999
AVERAGEMASS	1424.2043400000002
SMILES	C(O1)(C(C(O)C(O)C(Oc(c(c(c7)cc(OC(C8O)OC(COC(=O)c(c%10)ccc(c%10)OC(O9)C(O)C(O)C(C9CO)O)C(C(O)8)O)c(c7)O)6)cc(c5[o+1]6)c(O)cc(c5)OC(C(O)2)OC(COC(c(c4)ccc(c4)OC(C(O)3)OC(CO)C(C3O)O)=O)C(O)C2O)1)O)COC(=O)CC(=O)O
M  END

</pre>

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