Mol:FL2FA8NI0006

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 27  0  0  0  0  0  0  0  0999 V2000 
   -2.1425   -0.4158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1403   -1.2383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4233   -1.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7117   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7118   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4272   -0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0064   -1.6499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7173   -1.2373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7154   -0.4092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0026    0.0001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4298    0.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1426   -0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8570    0.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8569    0.8316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1424    1.2439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4280    0.8313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0064   -2.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8570   -0.0033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1420    2.0624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1420    1.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4272    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8566    2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4276    2.4748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1426   -1.1282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4233   -2.3503    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  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  6  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 
  1 18  1  0  0  0  0 
  6 21  1  0  0  0  0 
 19 20  2  0  0  0  0 
 20 21  1  0  0  0  0 
 19 22  1  0  0  0  0 
 19 23  1  0  0  0  0 
 12 24  1  0  0  0  0 
  3 25  1  0  0  0  0 
S  SKP  8 
ID	FL2FA8NI0006 
KNApSAcK_ID	C00014156 
NAME	Kushenol S;5,7,2'-Trihydroxy-8-prenylflavanone 
CAS_RN	254886-72-1 
FORMULA	C20H20O5 
EXACTMASS	340.13107375 
AVERAGEMASS	340.3698 
SMILES	c(C(C3)Oc(c(CC=C(C)C)2)c(C(=O)3)c(cc(O)2)O)(c(O)1)cccc1 
M  END