Mol:FL5FGANI0003

Revision as of 09:00, 7 October 2008

<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  31  32
M  SBL   3  1  33
M  SMT   3  OCH3
M  SVB   3 33   -2.9555   -1.1929
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  29  30
M  SBL   2  1  31
M  SMT   2  OCH3
M  SVB   2 31     0.183   -1.4906
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  27  28
M  SBL   1  1  29
M  SMT   1  OCH3
M  SVB   1 29     2.241     0.661
S  SKP  8
ID	FL5FGANI0003
KNApSAcK_ID	C00004935
NAME	Pratensin A;5,7,8-Trihydroxy-3,6,4'-trimethoxyflavone 8-tiglate;(E)-5,7-Dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl ester 2-methyl-2-butenoic acid
CAS_RN	142609-00-5
FORMULA	C23H22O9
EXACTMASS	442.126382302
AVERAGEMASS	442.41538
SMILES	O(C)c(c3)ccc(c3)C(O2)=C(OC)C(=O)c(c21)c(O)c(c(c(OC(C(C)=CC)=O)1)O)OC
M  END

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