Mol:FLIA1LGS0002

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FLIA1LGS0002.png

<pre>

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M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  41  42
M  SBL   2  1  45
M  SMT   2  CH2OH
M  SVB   2 45    3.8921   -1.3833
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  39  40
M  SBL   1  1  43
M  SMT   1  CH2OH
M  SVB   1 43   -4.4041    1.7958
S  SKP  8
ID	FLIA1LGS0002
KNApSAcK_ID	C00010141
NAME	2'-Hydroxydaidzein 7,4'-di-O-glucoside
CAS_RN	88048-22-0
FORMULA	C27H30O15
EXACTMASS	594.15847029
AVERAGEMASS	594.5181
SMILES	O[C@@H]([C@@H](O)1)[C@H](Oc(c2)ccc(C3=O)c(OC=C3c(c4)c(cc(O[C@@H](C5O)O[C@@H]([C@H](O)C(O)5)CO)c4)O)2)OC([C@H](O)1)CO
M  END

</pre>

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