Mol:FLIAEAGS0006

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FLIAEAGS0006.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  40  41
M  SBL   3  1  44
M  SMT   3  CH2OH
M  SVB   3 44    1.5983   -1.0063
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  44  45
M  SBL   2  1  48
M  SMT   2  OCH3
M  SVB   2 48   -3.5656    2.4123
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   -3.9229    1.2521
S  SKP  8
ID	FLIAEAGS0006
KNApSAcK_ID	C00010127
NAME	7-O-Methyltectorigenin 4'-O-gentiobioside
CAS_RN	68418-92-8
FORMULA	C29H34O16
EXACTMASS	638.18468504
AVERAGEMASS	638.57066
SMILES	c(c1)(OC)c(c(O)c(C(=O)2)c1OC=C2c(c3)ccc(O[C@H](O4)C(O)C([C@@H](O)[C@@H](CO[C@@H]([C@@H](O)5)OC([C@H](O)[C@@H]5O)CO)4)O)c3)OC
M  END

</pre>

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