Mol:FL3F1CNS0002

<pre>

Copyright: ARM project http://www.metabolome.jp/
 21 23  0  0  0  0  0  0  0  0999 V2000
   -1.9630   -0.2074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9630   -0.8498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4067   -1.1710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8504   -0.8498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8504   -0.2074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4067    0.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2941   -1.1710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2622   -0.8498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2622   -0.2074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2941    0.1138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2941   -1.6718    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8183    0.1136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3853   -0.2137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9523    0.1136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9523    0.7683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3853    1.0957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8183    0.7683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5191    0.1136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9523    0.7683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6687    1.6718    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1101    2.5691    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
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  20  21
M  SBL   1  1  22
M  SMT   1  OCH3
M  SVB   1 22    1.6687    1.6718
S  SKP  8
ID	FL3F1CNS0002
KNApSAcK_ID	C00003826
NAME	Geraldone
CAS_RN	21583-32-4
FORMULA	C16H12O5
EXACTMASS	284.068473494
AVERAGEMASS	284.26348
SMILES	COc(c(O)3)cc(cc3)C(=C1)Oc(c2)c(ccc(O)2)C(=O)1
M  END

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