Mol:FL5FELGS0005

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 37 40  0  0  0  0  0  0  0  0999 V2000 
    3.1230    0.1640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4086    0.5765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4086    1.4015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1230    1.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8375    1.4015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8375    0.5765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6941    0.1640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9796    0.5765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2652    0.1640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2652   -0.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9796   -1.0735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6941   -0.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4493    0.5765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1638    0.1640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1638   -0.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4493   -1.0735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9796   -1.7805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8783    0.5765    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4493   -1.8140    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4798    1.7723    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1230   -0.5136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3647   -1.0482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3647   -1.7826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8636   -1.0651    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4686   -0.7158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1615    1.3787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.6783    0.7717    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.2657    0.0570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4674    0.2661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6739    0.0392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0865    0.7540    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8848    0.5449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.0418    1.1308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.5217    1.4078    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -5.1615    0.2885    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.7144    0.3160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.6388   -0.3738    0.0000 O   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 
  2  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12  7  2  0  0  0  0 
  9 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 10  1  0  0  0  0 
 14 18  1  0  0  0  0 
 11 17  2  0  0  0  0 
 16 19  1  0  0  0  0 
  5 20  1  0  0  0  0 
  1 21  1  0  0  0  0 
 12 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 15 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
 20 26  1  0  0  0  0 
 27 28  1  1  0  0  0 
 28 29  1  1  0  0  0 
 30 29  1  1  0  0  0 
 30 31  1  0  0  0  0 
 31 32  1  0  0  0  0 
 32 27  1  0  0  0  0 
 32 33  1  0  0  0  0 
 33 34  1  0  0  0  0 
 27 35  1  0  0  0  0 
 28 36  1  0  0  0  0 
 29 37  1  0  0  0  0 
 30 18  1  0  0  0  0 
S  SKP  8 
ID	FL5FELGS0005 
KNApSAcK_ID	C00013996 
NAME	Tridaxidone;5,7,2'-Trihydroxy-3,6,4'-trimethoxyflavone 7-glucoside;7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(2-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-4H-1-benzopyran-4-one 
CAS_RN	439147-54-3 
FORMULA	C24H26O13 
EXACTMASS	522.137340918 
AVERAGEMASS	522.45544 
SMILES	O(c(c(O)3)c(OC(C4O)OC(CO)C(O)C4O)cc(c31)OC(c(c(O)2)ccc(OC)c2)=C(OC)C1=O)C 
M  END