Mol:FL1C9ANS0003

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FL1C9ANS0003.png

 
 
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 19 20  0  0  0  0  0  0  0  0999 V2000 
   -2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8579   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4289   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7145   -1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7145    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5724   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5724    1.2375    0.0000 O   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 
  5 17  1  0  0  0  0 
  2 18  1  0  0  0  0 
 14 19  1  0  0  0  0 
S  SKP  8 
ID	FL1C9ANS0003 
KNApSAcK_ID	C00014420 
NAME	4,2',5'-Trihydroxychalcone 
CAS_RN	193746-17-7 
FORMULA	C15H12O4 
EXACTMASS	256.073558872 
AVERAGEMASS	256.25338 
SMILES	Oc(c2)ccc(c2)C=CC(=O)c(c1)c(O)ccc(O)1 
M  END
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