Mol:FL3FECNS0016

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 28  0  0  0  0  0  0  0  0999 V2000 
   -2.2410   -0.1713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2410   -0.8137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6847   -1.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1284   -0.8137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1284   -0.1713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6847    0.1499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5721   -1.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0158   -0.8137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0158   -0.1713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5721    0.1499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5721   -1.6357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5403    0.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1072   -0.1776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6742    0.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6742    0.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1072    1.1318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5403    0.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7971    0.1497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3907    1.7079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8322    2.6051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9555   -0.7222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9474   -0.5952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6742    0.8044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6742    0.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6847   -2.1349    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6847   -3.1349    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 
  7 11  2  0  0  0  0 
  9 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 12  1  0  0  0  0 
  1 18  1  0  0  0  0 
 16 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
  2 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 15 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
  3 25  1  0  0  0  0 
 25 26  1  0  0  0  0 
M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  25  26 
M  SBL   4  1  27 
M  SMT   4  OCH3 
M  SVB   4 27   -2.1212   -1.2954 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  23  24 
M  SBL   3  1  25 
M  SMT   3  OCH3 
M  SVB   3 25     2.241    1.1317 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  21  22 
M  SBL   2  1  23 
M  SMT   2  OCH3 
M  SVB   2 23   -2.9555   -0.7222 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  19  20 
M  SBL   1  1  21 
M  SMT   1  OCH3 
M  SVB   1 21    1.3907    1.7079 
S  SKP  8 
ID	FL3FECNS0016 
KNApSAcK_ID	C00003897 
NAME	6-Hydroxyluteolin 5,6,3',4'-tetramethyl ether 
CAS_RN	40983-99-1 
FORMULA	C19H18O7 
EXACTMASS	358.10525293 
AVERAGEMASS	358.34202000000005 
SMILES	O(C(c(c3)cc(OC)c(OC)c3)=2)c(c(C(=O)C2)1)cc(c(c1OC)OC)O 
M  END