Mol:FL3FACGS0027

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FL3FACGS0027.png

<pre>

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M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  42  43
M  SBL   2  1  46
M  SMT   2  CH2OH
M  SVB   2 46   -2.6841   -0.7103
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  40  41
M  SBL   1  1  44
M  SMT   1  CH2OH
M  SVB   1 44   -2.5405    1.1066
S  SKP  8
ID	FL3FACGS0027
KNApSAcK_ID	C00004286
NAME	Luteolin 7-allosyl-(1->2)-glucoside
CAS_RN	113471-89-9
FORMULA	C27H30O16
EXACTMASS	610.153384912
AVERAGEMASS	610.5175
SMILES	c(c1)c(c(O)cc1C(=C5)Oc(c(C(=O)5)2)cc(O[C@H](O4)[C@H]([C@@H](O)[C@H](C4CO)O)O[C@H](O3)[C@H]([C@@H](O)[C@H](C3CO)O)O)cc2O)O
M  END

</pre>

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