Mol:FL4DPTNS0004

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 27  0  0  0  0  0  0  0  0999 V2000
   -1.8429   -0.7900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3220   -1.0907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8011   -0.7900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8011   -0.1885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3220    0.1122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8429   -0.1885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2802   -1.0907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2407   -0.7900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2407   -0.1885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2802    0.1122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7610    0.1119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2802   -1.6146    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2954   -0.1966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8298    0.1119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8298    0.7289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2954    1.0374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7610    0.7289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7708   -1.1604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2864   -0.7892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3632    0.1119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3632    1.0369    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2954    1.6534    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7763   -1.2409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0618   -1.6534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  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  4  1  0  0  0  0
  9 11  1  6  0  0  0
  7 12  2  0  0  0  0
 11 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 11  1  0  0  0  0
  8 18  1  1  0  0  0
 13 19  1  0  0  0  0
 19 18  1  0  0  0  0
  6 20  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
  2 23  1  0  0  0  0
 23 24  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  23  24
M  SBL   1  1  26
M  SMT   1 OCH3
M  SBV   1 26   -8.5069    4.2168
S  SKP  8
ID	FL4DPTNS0004
KNApSAcK_ID	C00008604
NAME	5-Methoxypeltogynone
CAS_RN	38279-47-9
FORMULA	C17H14O7
EXACTMASS	330.073952802
AVERAGEMASS	330.28886
SMILES	COc(c4)c(C(=O)1)c(cc(O)4)OC(c32)C(OCc(cc(O)c(O)c3)2)1
M  END

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