Mol:FL3FAENS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 22 24  0  0  0  0  0  0  0  0999 V2000 
   -2.1534    0.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1534   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6530   -0.7485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1525   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1525    0.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6530    0.4073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6521   -0.7485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1516   -0.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1516    0.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6521    0.4073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3485    0.4071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8788    0.1009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4092    0.4071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4092    1.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8788    1.3257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3485    1.0195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6536    0.4071    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6521   -1.3257    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9391    0.1011    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6530   -1.2074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9391    1.3254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6536    0.9129    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  2  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 
  1 17  1  0  0  0  0 
  7 18  2  0  0  0  0 
 13 19  1  0  0  0  0 
  3 20  1  0  0  0  0 
 14 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  21  22 
M  SBL   1  1  23 
M  SMT   1 OCH3 
M  SBV   1 23   -5.3422    4.0336 
S  SKP  8 
ID	FL3FAENS0001 
KNApSAcK_ID	C00001036 
NAME	Diosmetin;5,7,3'-Trihydroxy-4'-methoxyflavone;4'-Methylluteolin 
CAS_RN	520-34-3 
FORMULA	C16H12O6 
EXACTMASS	300.063388116 
AVERAGEMASS	300.26288 
SMILES	COc(c3)c(O)cc(c3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1 
M  END