Mol:FL2F19NI0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 25  0  0  0  0  0  0  0  0999 V2000 
   -1.6796   -0.3499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6796   -0.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1233   -1.3134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5670   -0.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5670   -0.3499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1233   -0.0287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0107   -1.3134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5456   -0.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5456   -0.3499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0107   -0.0287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1017   -0.0288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6687   -0.3562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2357   -0.0288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2357    0.6259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6687    0.9532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1017    0.6259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0107   -1.8572    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1233    0.6002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6679    0.9146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2357   -0.0288    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6679    1.5430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2121    1.8572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1237    1.8572    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 
 19 21  2  0  0  0  0 
 21 22  1  0  0  0  0 
 21 23  1  0  0  0  0 
S  SKP  8 
ID	FL2F19NI0003 
KNApSAcK_ID	C00008136 
NAME	Ovaliflavanone B 
CAS_RN	78045-73-5 
FORMULA	C20H20O3 
EXACTMASS	308.141244506 
AVERAGEMASS	308.371 
SMILES	C(c(c3O)c(c(cc3)2)OC(CC2=O)c(c1)cccc1)C=C(C)C 
M  END