Mol:FLNABENM0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 27  0  0  0  0  0  0  0  0999 V2000
   -1.0639    1.5901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5076    1.9113    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0485    1.5902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0485    0.9242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6253    0.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2020    0.9242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2020    1.5902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6253    1.9232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0639    0.9481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5076    0.6270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6253   -0.0742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0723   -0.3935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0723   -1.0319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6253   -1.3512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1782   -1.0319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1782   -0.3935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7783    1.9229    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6200    1.9111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7307   -1.3509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1871   -1.5107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9015   -1.9232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5075   -0.3730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5074   -1.3730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7783    1.0395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3842    0.2439    0.0000 O   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  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  5 11  1  0  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
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
 15 19  1  0  0  0  0
 14 20  1  0  0  0  0
 20 21  1  0  0  0  0
 10 22  1  0  0  0  0
 22 23  1  0  0  0  0
  9 24  1  0  0  0  0
 24 25  2  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  22  23
M  SBL   2  1  24
M  SMT   2  OCH3
M  SVB   2 24   -0.9466     0.462
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    0.1871   -1.5107
S  SKP  8
ID	FLNABENM0001
KNApSAcK_ID	C00010244
NAME	7,3'-Dihydroxy-5,4'-dimethoxy-6-formyl-4-phenylcoumarin
CAS_RN	91377-14-9
FORMULA	C18H14O7
EXACTMASS	342.073952802
AVERAGEMASS	342.29956000000004
SMILES	c(c3C=O)(O)cc(c(c3OC)1)OC(=O)C=C(c(c2)cc(O)c(OC)c2)1
M  END

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