Mol:FL4DAANI0007

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 33  0  0  0  0  0  0  0  0999 V2000 
    0.2625   -0.4705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7834   -0.7713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3043   -0.4705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3043    0.1309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7834    0.4317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2625    0.1309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8252   -0.7713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3460   -0.4705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3460    0.1309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8252    0.4317    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8252   -1.2952    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7834   -1.3721    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9301    0.4682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4520    0.1668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9739    0.4682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9739    1.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4520    1.3721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9301    1.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8821   -1.0066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4955    1.3719    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9079    0.1414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4271    0.4411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9079   -0.4581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9451    0.1420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4619    0.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9787    0.1420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.4955    0.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9787   -0.4547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2399    0.4210    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7659    0.1173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2599    0.4025    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 
  3  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  4  1  0  0  0  0 
  7 11  2  0  0  0  0 
  2 12  1  0  0  0  0 
  9 13  1  6  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 17  1  0  0  0  0 
 17 18  2  0  0  0  0 
 18 13  1  0  0  0  0 
  8 19  1  1  0  0  0 
 16 20  1  0  0  0  0 
 21 22  1  0  0  0  0 
 21 23  1  0  0  0  0 
 22 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
 25 26  2  0  0  0  0 
 26 27  1  0  0  0  0 
 26 28  1  0  0  0  0 
  6 29  1  0  0  0  0 
 29 30  1  0  0  0  0 
 30 31  1  0  0  0  0 
 31 21  2  0  0  0  0 
S  SKP  8 
ID	FL4DAANI0007 
KNApSAcK_ID	C00008648 
NAME	3,5,4'-Trihydroxy-7-geranyloxyflavanone 
CAS_RN	160036-21-5 
FORMULA	C25H28O6 
EXACTMASS	424.188588628 
AVERAGEMASS	424.48622 
SMILES	c(c3)c(ccc3O)C(C(O)2)Oc(c1C2=O)cc(cc(O)1)OCC=C(CCC=C(C)C)C 
M  END