Mol:FLIA3AGS0003

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FLIA3AGS0003.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  41  42
M  SBL   4  1  45
M  SMT   4  CH2OH
M  SVB   4 45   -2.2624    1.4332
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  37  38
M  SBL   3  1  41
M  SMT   3  CH2OH
M  SVB   3 41   -4.4693    0.6082
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  43  44
M  SBL   2  1  47
M  SMT   2  OCH3
M  SVB   2 47    1.0347    1.5741
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  39  40
M  SBL   1  1  43
M  SMT   1  OCH3
M  SVB   1 43    4.3394   -1.1616
S  SKP  8
ID	FLIA3AGS0003
KNApSAcK_ID	C00010096
NAME	8-O-Methylretusin 7-O-laminaribioside
CAS_RN	56222-46-9
FORMULA	C29H34O15
EXACTMASS	622.189770418
AVERAGEMASS	622.5712599999999
SMILES	O([C@@H]([C@H]5O)OC([C@@H]([C@H](O)5)O)CO)[C@H]([C@H](O)1)[C@H](C(O[C@H]1Oc(c4OC)ccc(c24)C(C(c(c3)ccc(OC)c3)=CO2)=O)CO)O
M  END

</pre>

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