Mol:FL5FADGL0016

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FL5FADGL0016.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  44  45
M  SBL   3  1  48
M  SMT   3  CH2OH
M  SVB   3 48    1.4804   -1.4294
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  40  41
M  SBL   2  1  44
M  SMT   2  CH2OH
M  SVB   2 44    3.5841    1.1281
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  42  43
M  SBL   1  1  46
M  SMT   1  OCH3
M  SVB   1 46     0.142     1.739
S  SKP  8
ID	FL5FADGL0016
KNApSAcK_ID	C00005561
NAME	Isorhamnetin 3,4'-diglucoside
CAS_RN	28288-98-4
FORMULA	C28H32O17
EXACTMASS	640.163949598
AVERAGEMASS	640.54348
SMILES	C(C5O)([C@@H](O[C@@H]([C@@H]5O)CO)Oc(c4)c(OC)cc(c4)C(=C(O[C@H](O3)C(C([C@@H](O)[C@H]3CO)O)O)2)Oc(c1)c(C(=O)2)c(cc1O)O)O
M  END

</pre>

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