Mol:FL5FEAGA0004

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Copyright: ARM project http://www.metabolome.jp/
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  8  9  2  0  0  0  0
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  2 34  1  0  0  0  0
 34 35  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  32  33
M  SBL   3  1  35
M  SMT   3  CH2OH
M  SVB   3 35    3.2935   -1.5134
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  34  35
M  SBL   2  1  37
M  SMT   2  OCH3
M  SVB   2 37   -3.2935   -0.3407
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  30  31
M  SBL   1  1  33
M  SMT   1  OCH3
M  SVB   1 33    1.9031    1.5133
S  SKP  8
ID	FL5FEAGA0004
KNApSAcK_ID	C00005329
NAME	Betuletol 3-galactoside
CAS_RN	128450-83-9
FORMULA	C23H24O12
EXACTMASS	492.126776232
AVERAGEMASS	492.42946
SMILES	O(C)c(c1)ccc(C(O4)=C(C(=O)c(c43)c(c(OC)c(c3)O)O)O[C@H](O2)C(O)C([C@H]([C@@H](CO)2)O)O)c1
M  END

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