Mol:FL1CRTNI0004

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FL1CRTNI0004.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 27  0  0  0  0  0  0  0  0999 V2000 
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    0.0000    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8579    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8579    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5724    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  2  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  1  1  0  0  0  0 
  3  7  1  0  0  0  0 
  2  8  1  0  0  0  0 
  5  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
  9 11  1  0  0  0  0 
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 13 14  2  0  0  0  0 
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 15 16  2  0  0  0  0 
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 24 25  1  0  0  0  0 
 24 26  1  0  0  0  0 
S  SKP  8 
ID	FL1CRTNI0004 
KNApSAcK_ID	C00014487 
NAME	Licoagrochalcone C;3-Prenyl-4,3',4'-trihydroxy-2-methoxychalcone 
CAS_RN	325144-68-1 
FORMULA	C21H22O5 
EXACTMASS	354.146723814 
AVERAGEMASS	354.39638 
SMILES	c(OC)(c(C=CC(=O)c(c2)ccc(c2O)O)1)c(c(O)cc1)CC=C(C)C 
M  END
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