Mol:FL2F19NI0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 28 30  0  0  0  0  0  0  0  0999 V2000 
   -0.8484   -0.3025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8484   -0.9448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2921   -1.2660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2642   -0.9448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2642   -0.3025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2921    0.0187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8205   -1.2660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3768   -0.9448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3768   -0.3025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8205    0.0187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9329    0.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4999   -0.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0668    0.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0668    0.6733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4999    1.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9329    0.6733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8205   -1.8098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2921    0.6476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8367    0.9620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4045    0.0186    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4045   -1.2659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9594   -0.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5131   -1.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0668   -0.9455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5131   -1.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8367    1.5904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3809    1.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2926    1.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  9 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 
  7 17  2  0  0  0  0 
  6 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
  1 20  1  0  0  0  0 
  2 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  2  0  0  0  0 
 23 24  1  0  0  0  0 
 23 25  1  0  0  0  0 
 19 26  2  0  0  0  0 
 26 27  1  0  0  0  0 
 26 28  1  0  0  0  0 
S  SKP  8 
ID	FL2F19NI0002 
KNApSAcK_ID	C00008135 
NAME	Ovaliflavanone A 
CAS_RN	59920-27-3 
FORMULA	C25H28O3 
EXACTMASS	376.203844762 
AVERAGEMASS	376.48802 
SMILES	c(CC=C(C)C)(c3O)cc(c2c3CC=C(C)C)C(=O)CC(O2)c(c1)cccc1 
M  END