Mol:FL3FECGS0025

<pre>

Copyright: ARM project http://www.metabolome.jp/
 34 37  0  0  0  0  0  0  0  0999 V2000
   -0.3379    0.4912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3379   -0.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1132   -0.3313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5642   -0.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5642    0.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1132    0.7104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0153   -0.3313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4663   -0.0709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4663    0.4500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0153    0.7104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1870   -0.6992    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9172    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3770    0.4449    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8367    0.7103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8367    1.2411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3770    1.5066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9172    1.2411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3770    2.1103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4269    1.5819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1132   -0.8510    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7880   -0.3307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1387   -1.0043    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.6231   -1.6849    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8806   -1.3961    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.1641   -1.3884    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.6847   -0.8677    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3343   -1.2105    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.9246   -0.2052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4269   -1.7240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4551   -2.1103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6852    1.1273    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1644    2.0050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5911   -0.6095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3089    0.1657    0.0000 O   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
 16 18  1  0  0  0  0
 19 15  1  0  0  0  0
  3 20  1  0  0  0  0
  2 21  1  0  0  0  0
 22 23  1  1  0  0  0
 23 24  1  1  0  0  0
 25 24  1  1  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 22  1  0  0  0  0
 22 28  1  0  0  0  0
 23 29  1  0  0  0  0
 24 30  1  0  0  0  0
 25 21  1  0  0  0  0
  1 31  1  0  0  0  0
 31 32  1  0  0  0  0
 27 33  1  0  0  0  0
 33 34  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  33  34
M  SBL   2  1  36
M  SMT   2  CH2OH
M  SVB   2 36    -2.039   -0.6275
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  SVB   1 34   -0.6852    1.1273
S  SKP  8
ID	FL3FECGS0025
KNApSAcK_ID	C00004404
NAME	6-Hydroxyluteolin 7-methyl ether 6-galactoside
CAS_RN	76449-91-7
FORMULA	C22H22O12
EXACTMASS	478.111126168
AVERAGEMASS	478.40288000000004
SMILES	C(C(=O)4)=C(Oc(c42)cc(c(O[C@H](O3)[C@@H](O)[C@H]([C@H](C(CO)3)O)O)c2O)OC)c(c1)ccc(c1O)O
M  END

</pre>