Mol:FL2FAANI0024

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 33  0  0  0  0  0  0  0  0999 V2000 
    4.5980   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5980    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7320   -1.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641    0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7320   -2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301    0.2500    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    2.8660    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    1.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    2.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6611    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5280    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6611    1.3700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
   12.3949    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5280   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   13.2618    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   14.1287    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   14.9956    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   15.8625    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   14.9956   -0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  1  3  1  0  0  0  0 
  1  4  1  0  0  0  0 
  2  5  1  0  0  0  0 
  2  6  1  0  0  0  0 
  3  7  1  0  0  0  0 
  3  8  2  0  0  0  0 
  4  9  2  0  0  0  0 
  4 10  1  0  0  0  0 
  5 11  1  0  0  0  0 
  6 12  2  0  0  0  0 
  7 11  1  0  0  0  0 
  9 12  1  0  0  0  0 
 11 13  1  0  0  0  0 
 12 14  1  0  0  0  0 
 13 15  1  0  0  0  0 
 13 16  2  0  0  0  0 
 15 17  2  0  0  0  0 
 16 18  1  0  0  0  0 
 17 19  1  0  0  0  0 
 17 20  1  0  0  0  0 
 18 19  2  0  0  0  0 
 19 21  1  0  0  0  0 
 20 22  1  0  0  0  0 
 22 23  2  0  0  0  0 
 22 24  1  0  0  0  0 
 23 25  1  0  0  0  0 
 23 26  1  0  0  0  0 
 25 27  1  0  0  0  0 
 27 28  1  0  0  0  0 
 28 29  2  0  0  0  0 
 29 30  1  0  0  0  0 
 29 31  1  0  0  0  0 
S  SKP  9 
ID	FL2FAANI0024 
KNApSAcK_ID	C00014186 
NAME	Macarangaflavanone A;5,7,4'-Trihydroxy-3'-geranylflavanone 
CAS_RN	171370-48-2 
FORMULA	C25H28O5 
EXACTMASS	408.193674006 
AVERAGEMASS	408.48682 
SMILES	c(c3)(cc(C=C(C)CCCC=C(C)C)c(c3)O)C(C2)Oc(c(C(=O)2)1)cc(cc1O)O 
M  END