Mol:FL5FECNS0029

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FL5FECNS0029.png

 
 
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  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
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  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
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M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  26  27 
M  SBL   4  1  28 
M  SMT   4  OCH3 
M  SVB   4 28     2.241     1.127 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  24  25 
M  SBL   3  1  26 
M  SMT   3  OCH3 
M  SVB   3 26     0.183   -1.0246 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  22  23 
M  SBL   2  1  24 
M  SMT   2  OCH3 
M  SVB   2 24   -2.9555   -0.7269 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  20  21 
M  SBL   1  1  22 
M  SMT   1  OCH3 
M  SVB   1 22   -2.5983    0.4428 
S  SKP  8 
ID	FL5FECNS0029 
KNApSAcK_ID	C00004705 
NAME	Casticin;3,6,7,4'-Tetra-O-methyl-5,3'-dihydroxyflavone;Quercetagetin 3,6,7,4'-tetramethyl ether;Vitexicarpin;5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one 
CAS_RN	479-91-4 
FORMULA	C19H18O8 
EXACTMASS	374.100167552 
AVERAGEMASS	374.34142 
SMILES	c(c3OC)c(O1)c(c(c3OC)O)C(C(=C1c(c2)cc(O)c(OC)c2)OC)=O 
M  END
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