Mol:FL2FA9NC0013

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 37 41  0  0  0  0  0  0  0  0999 V2000 
   -2.1640    2.1596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8783    1.7467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8778    0.9217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1631    0.5096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4489    0.9226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4493    1.7476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1626   -0.3154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4479   -0.7274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7337   -0.3145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7341    0.5105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4474   -1.5524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7327   -1.9645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0185   -1.5516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0190   -0.7266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6962   -1.9637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4104   -1.5508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4100   -0.7258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6953   -0.3137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0389   -0.3623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7536   -0.7744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4678   -0.3614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4673    0.4636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7526    0.8756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0384    0.4627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6966   -2.6167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7323   -2.7764    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9208    2.0531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9992    2.7764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4599    2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4437    2.0728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4678    1.0795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1876    0.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.0046   -1.8745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0767    0.8905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0767    1.7155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6377    0.4780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6919    0.2044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  1  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  8 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  9  1  0  0  0  0 
 13 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  1  0  0  0  0 
 17 18  1  0  0  0  0 
 18 14  1  0  0  0  0 
 17 19  1  0  0  0  0 
 19 20  2  0  0  0  0 
 20 21  1  0  0  0  0 
 21 22  2  0  0  0  0 
 22 23  1  0  0  0  0 
 23 24  2  0  0  0  0 
 24 19  1  0  0  0  0 
 15 25  2  0  0  0  0 
 12 26  1  0  0  0  0 
 10 34  1  0  0  0  0 
  6 27  2  0  0  0  0 
  1 28  1  0  0  0  0 
  1 29  1  0  0  0  0 
  2 30  2  0  0  0  0 
  3 31  1  0  0  0  0 
  3 32  1  0  0  0  0 
 11 33  1  0  0  0  0 
 34 35  1  0  0  0  0 
 34 36  1  0  0  0  0 
  4 37  1  0  0  0  0 
S  SKP  8 
ID	FL2FA9NC0013 
KNApSAcK_ID	C00014280 
NAME	Lumaflavanone C 
CAS_RN	424838-73-3 
FORMULA	C30H34O7 
EXACTMASS	506.230453442 
AVERAGEMASS	506.58676 
SMILES	O=C(C5(C)C)C(C(O)(O1)C(C5=O)C(c(c23)c(c(c(c2C(CC(c(c4)cccc4)O3)=O)O)C)1)C(C)C)(C)C 
M  END