Mol:FL3FABGS0002

<pre>

Copyright: ARM project http://www.metabolome.jp/
 32 35  0  0  0  0  0  0  0  0999 V2000
   -0.4867    0.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4867   -0.4553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0356   -0.7158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4154   -0.4553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4154    0.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0356    0.3259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8665   -0.7158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3176   -0.4553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3176    0.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8665    0.3259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8665   -1.1218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7685    0.3258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2282    0.0604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6879    0.3258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6879    0.8567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2282    1.1221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7685    0.8567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9376    0.3258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0356   -1.1221    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5738    0.1792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0582   -0.5014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3157   -0.2127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5992   -0.2050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1198    0.3158    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8783    0.0434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3392    1.0545    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8620   -0.5406    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8370    0.5797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7851   -0.7433    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4697    0.6781    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1475    1.1220    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8620    0.7095    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
 19  3  1  0  0  0  0
 20 21  1  1  0  0  0
 21 22  1  1  0  0  0
 23 22  1  1  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 25 28  1  0  0  0  0
 22 29  1  0  0  0  0
 28 30  1  0  0  0  0
 23 18  1  0  0  0  0
 15 31  1  0  0  0  0
 31 32  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  31  32
M  SBL   1  1  34
M  SMT   1 OCH3
M  SBV   1 34   -5.3194    3.5675
S  SKP  8
ID	FL3FABGS0002
KNApSAcK_ID	C00004202
NAME	Acacetin 7-galactoside
CAS_RN	35013-09-3
FORMULA	C22H22O10
EXACTMASS	446.121296924
AVERAGEMASS	446.40408
SMILES	C(C1O)(C(C(OC1Oc(c4)cc(c(c4O)3)OC(=CC3=O)c(c2)ccc(OC)c2)CO)O)O
M  END

</pre>