Mol:FL1CHYNS0009

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FL1CHYNS0009.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 28  0  0  0  0  0  0  0  0999 V2000 
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    1.8369   -0.2404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    3.2658   -0.2404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2658    0.5846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5513    0.9971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8369    0.5846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1224   -1.4779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8789    1.1367    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5433    1.8904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7229    1.8041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3065    0.9971    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4079    0.5846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1644    0.9971    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8789    0.5846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7355   -1.4779    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4500   -1.8904    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 
  4  7  1  0  0  0  0 
  7  8  2  0  0  0  0 
  7  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
 10 17  1  0  0  0  0 
 14 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 15  1  0  0  0  0 
  5 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
  1 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
  3 25  1  0  0  0  0 
 25 26  1  0  0  0  0 
S  SKP  8 
ID	FL1CHYNS0009 
KNApSAcK_ID	C00014438 
NAME	Ponganone X;3,4-Methylenedioxy-2',4',6'-trimethoxy-beta-hydroxychalcone 
CAS_RN	142608-96-6 
FORMULA	C19H18O7 
EXACTMASS	358.10525293 
AVERAGEMASS	358.34202000000005 
SMILES	c(c32)(OCO3)ccc(c2)C(O)=CC(c(c(OC)1)c(OC)cc(OC)c1)=O 
M  END
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