Mol:FL7ABGGL0001

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Copyright: ARM project http://www.metabolome.jp/
 34 37  0  0  0  0  0  0  0  0999 V2000
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  1 17  1  0  0  0  0
 14 18  1  0  0  0  0
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 24 33  1  0  0  0  0
 33 34  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  33  34
M  SBL   2  1  36
M  SMT   2  CH2OH
M  SVB   2 36    2.3445   -1.5473
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  31  32
M  SBL   1  1  34
M  SMT   1  OCH3
M  SVB   1 34    -2.383   -1.1219
S  SKP  8
ID	FL7ABGGL0001
KNApSAcK_ID	C00006746
NAME	Pulchellidin 3-glucoside
CAS_RN	-
FORMULA	C22H23O12
EXACTMASS	479.1189512
AVERAGEMASS	479.41082
SMILES	[C@@H](Oc(c(c(c4)cc(O)c(O)c(O)4)2)cc(c3OC)c(cc(c3)O)[o+1]2)(C(O)1)O[C@H](CO)[C@@H](C1O)O
M  END

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