Mol:FL2FA8NS0007

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 22 24  0  0  0  0  0  0  0  0999 V2000 
   -2.1940    0.1441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1940   -0.6809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -0.0506   -1.0934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6639   -0.6809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6639    0.1441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0506    0.5566    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4224    0.5820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1368    0.1695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8513    0.5820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8513    1.4070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1368    1.8195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4224    1.4070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0506   -1.8195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4795   -1.7866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1368   -0.5162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5200    0.1959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8644    0.5311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5200    0.1526    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 
  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 
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  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 
  3 18  1  0  0  0  0 
 12 19  1  0  0  0  0 
 13 20  1  0  0  0  0 
  1 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
S  SKP  8 
ID	FL2FA8NS0007 
KNApSAcK_ID	C00014118 
NAME	5,2',3'-Trihydroxy-7-methoxyflavanone 
CAS_RN	188440-66-6 
FORMULA	C16H14O6 
EXACTMASS	302.07903818 
AVERAGEMASS	302.27876000000003 
SMILES	COc(c3)cc(O1)c(c(O)3)C(=O)CC1c(c2)c(O)c(O)cc2 
M  END