Mol:FL2FAEGS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 44 48  0  0  0  0  0  0  0  0999 V2000
   -0.8011   -0.8644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8011   -1.4423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3006   -1.7312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1998   -1.4423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1998   -0.8644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3006   -0.5755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7003   -1.7312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2007   -1.4423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2007   -0.8644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7003   -0.5755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7009   -0.5757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2152   -0.8726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7296   -0.5757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7296    0.0182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2152    0.3152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7009    0.0182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2007   -0.1838    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3006   -2.3087    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3012   -0.5757    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8127   -0.8710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5854   -0.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1203   -1.2470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5489   -0.9213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3563   -0.4562    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9278   -0.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0953   -1.3749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9241    0.1036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9573   -1.1538    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7662   -1.4201    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7003   -2.1028    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0286    1.8168    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3842    1.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7003    1.3963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0124    1.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6567    1.8168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3406    1.6214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2950    1.2009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7003    2.1056    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2065    1.6962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9438    2.3087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0404    0.6055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2428   -0.8720    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2428    0.3145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9573   -0.0980    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
 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
  9 17  1  1  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 19 20  1  0  0  0  0
 21 22  1  1  0  0  0
 22 23  1  1  0  0  0
 20 23  1  1  0  0  0
 20 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 21  1  0  0  0  0
 23 26  1  0  0  0  0
 25 27  1  0  0  0  0
 21 28  1  0  0  0  0
 22 29  1  0  0  0  0
  7 30  2  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  1  0  0  0
 33 34  1  1  0  0  0
 35 34  1  1  0  0  0
 35 36  1  0  0  0  0
 36 31  1  0  0  0  0
 34 37  1  0  0  0  0
 33 38  1  0  0  0  0
 35 39  1  0  0  0  0
 36 40  1  0  0  0  0
 32 41  1  0  0  0  0
 41 27  1  0  0  0  0
 13 42  1  0  0  0  0
 14 43  1  0  0  0  0
 43 44  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  43  44
M  SBL   1  1  47
M  SMT   1 OCH3
M  SBV   1 47   -5.4090    3.3919
S  SKP  8
ID	FL2FAEGS0001
KNApSAcK_ID	C00000970
NAME	Hesperidin
CAS_RN	520-26-3
FORMULA	C28H34O15
EXACTMASS	610.189770418
AVERAGEMASS	610.56056
SMILES	c(c1)c(OC)c(O)cc1C([H])(O5)CC(c(c25)c(cc(OC(O3)C(O)C(O)C(O)C3COC(O4)C(C(C(O)C(C)4)O)O)c2)O)=O
M  END

</pre>