Mol:FL3FAINS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 26  0  0  0  0  0  0  0  0999 V2000 
   -1.4245   -1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4245   -0.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1390    0.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8535   -0.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8534   -1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1390   -1.6293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7100   -1.6293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0044   -1.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0044   -0.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7100    0.0207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7189    0.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4334   -0.3918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1478    0.0207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1478    0.8457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4333    1.2582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7189    0.8457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7100   -2.3423    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7998    1.2222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5679    0.0207    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1390   -2.3264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4333    1.9813    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8582   -0.3894    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5679    0.0203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8082    2.3423    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 
  1  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  2  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 
 14 18  1  0  0  0  0 
  4 19  1  0  0  0  0 
  6 20  1  0  0  0  0 
 15 21  1  0  0  0  0 
 13 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 21 24  1  0  0  0  0 
S  SKP  8 
ID	FL3FAINS0001 
KNApSAcK_ID	C00013329 
NAME	Tricin;5,7,4'-Trihydroxy-3',5'-dimethoxyflavone;5,7-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-1-benzopyran-4-one 
CAS_RN	520-32-1 
FORMULA	C17H14O7 
EXACTMASS	330.073952802 
AVERAGEMASS	330.28886 
SMILES	COc(c1)c(O)c(OC)cc1C(=C2)Oc(c3)c(c(O)cc(O)3)C(=O)2 
M  END