Mol:FL3F9LNS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 29 31  0  0  0  0  0  0  0  0999 V2000
   -2.2410   -0.1713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2410   -0.8137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5721   -1.1349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0158   -0.8137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0158   -0.1713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5721    0.1499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5721   -1.6357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5403    0.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1072   -0.1776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6742    0.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6742    0.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1072    1.1318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5403    0.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6742    0.8044    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6742    0.8044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9555   -0.7222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9474   -0.5952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6762   -0.3412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3907   -0.7537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1830    1.4232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3170    2.2892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3907    1.7079    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8322    2.6051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6847   -2.1349    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6847   -3.1349    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
 15 18  1  0  0  0  0
 18 19  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 17 24  1  0  0  0  0
 24 25  1  0  0  0  0
 16 26  1  0  0  0  0
 26 27  1  0  0  0  0
  3 28  1  0  0  0  0
 28 29  1  0  0  0  0
M  STY  1   6 SUP
M  SLB  1   6   6
M  SAL   6  2  28  29
M  SBL   6  1  30
M  SMT   6  OCH3
M  SVB   6 30   -2.1212   -1.2954
M  STY  1   5 SUP
M  SLB  1   5   5
M  SAL   5  2  26  27
M  SBL   5  1  28
M  SMT   5  OCH3
M  SVB   5 28    1.3907    1.7079
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  24  25
M  SBL   4  1  26
M  SMT   4  OCH3
M  SVB   4 26     0.183    1.4232
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  22  23
M  SBL   3  1  24
M  SMT   3  OCH3
M  SVB   3 24    0.6762   -0.3412
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  20  21
M  SBL   2  1  22
M  SMT   2  OCH3
M  SVB   2 22   -2.9555   -0.7222
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  18  19
M  SBL   1  1  20
M  SMT   1  OCH3
M  SVB   1 20     2.241    1.1317
S  SKP  8
ID	FL3F9LNS0001
KNApSAcK_ID	C00003963
NAME	5,6,2',3',4',6'-Hexamethoxyflavone;5,6-Dimethoxy-2-(2,3,4,6-tetramethoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN	100742-33-4
FORMULA	C21H22O8
EXACTMASS	402.13146768
AVERAGEMASS	402.39458
SMILES	COc(c3OC)cc(c(c3OC)C(=C2)Oc(c1)c(C(=O)2)c(c(c1)OC)OC)OC
M  END

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