Mol:FL7ACDGL0001

<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  42  43
M  SBL   4  1  46
M  SMT   4  CH2OH
M  SVB   4 46   -3.2521   -0.7291
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  38  39
M  SBL   3  1  42
M  SMT   3  CH2OH
M  SVB   3 42    3.1888   -1.4781
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    -2.387    1.0201
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  40  41
M  SBL   1  1  44
M  SMT   1  OCH3
M  SVB   1 44    1.6019    2.2806
S  SKP  8
ID	FL7ACDGL0001
KNApSAcK_ID	C00006693
NAME	Rosinin
CAS_RN	20016-74-4
FORMULA	C29H35O16
EXACTMASS	639.192510072
AVERAGEMASS	639.5785999999999
SMILES	c(c5)(c2c(cc5OC)O[C@@H]([C@@H](O)4)OC(CO)[C@H](O)[C@H](O)4)[o+1]c(c(O[C@@H](C(O)3)O[C@@H]([C@H](O)C3O)CO)c2)c(c1)cc(OC)c(O)c1
M  END

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