Mol:FL5F1GGS0001

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Copyright: ARM project http://www.metabolome.jp/
 33 36  0  0  0  0  0  0  0  0999 V2000
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  7  8  1  0  0  0  0
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  1 18  1  0  0  0  0
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 32 33  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  32  33
M  SBL   1  1  35
M  SMT   1  CH2OH
M  SVB   1 35   -3.3489    0.1828
S  SKP  8
ID	FL5F1GGS0001
KNApSAcK_ID	C00005628
NAME	Robinetin 7-glucoside
CAS_RN	-
FORMULA	C21H20O12
EXACTMASS	464.095476104
AVERAGEMASS	464.37629999999996
SMILES	[C@H](Oc(c4)cc(c3c4)OC(=C(C3=O)O)c(c2)cc(O)c(O)c(O)2)(O1)[C@@H](O)[C@@H](O)[C@@H](O)C1CO
M  END

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