Mol:FL6F1CNS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 20 22  0  0  0  0  0  0  0  0999 V2000
   -2.0624   -0.4970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0624   -1.1394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5061   -1.4606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9498   -1.1394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9498   -0.4970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5061   -0.1758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3935   -1.4606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1628   -1.1394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1628   -0.4970    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.3935   -0.1758    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7189   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2859   -0.5033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8528   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8528    0.4787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2859    0.8061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7189    0.4787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4197    0.8060    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2859    1.4606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4197    0.1217    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9198    0.9877    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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  6  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
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
  1 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  19  20
M  SBL   1  1  21
M  SMT   1  OCH3
M  SVB   1 21   -2.4197    0.1217
S  SKP  8
ID	FL6F1CNS0001
KNApSAcK_ID	C00008758
NAME	3',4'-Dihydroxy-7-methoxyflavan
CAS_RN	-
FORMULA	C16H16O4
EXACTMASS	272.104859
AVERAGEMASS	272.29584
SMILES	COc(c3)cc(O1)c(c3)CC[C@H]1c(c2)cc(O)c(O)c2
M  END

</pre>