Mol:FLIA1LNS0007

<pre>

Copyright: ARM project http://www.metabolome.jp/
 23 26  0  0  0  0  0  0  0  0999 V2000
   -2.2752    0.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2752    0.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7189   -0.1816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1626    0.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1626    0.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7189    1.1031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6063   -0.1816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.7819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6063    1.1031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5061   -0.1815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5061   -0.8683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1009   -1.2117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6957   -0.8683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6957   -0.1815    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1009    0.1619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6063   -0.8238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7526    1.2117    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3489   -1.0806    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7526   -0.5249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3489    0.0307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2084   -0.7989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5061   -1.2114    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
  8 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
 18  1  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 15  1  0  0  0  0
 12 22  1  0  0  0  0
 22 23  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  22  23
M  SBL   1  1  25
M  SMT   1 ^OCH3
M  SBV   1 25   -6.9043    3.2645
S  SKP  8
ID	FLIA1LNS0007
KNApSAcK_ID	C00009404
NAME	Cuneatin;Maximaisoflavone G
CAS_RN	7741-28-8
FORMULA	C17H12O6
EXACTMASS	312.063388116
AVERAGEMASS	312.27358
SMILES	COc(c3)c(cc(O4)c(OC4)3)C(=C1)C(=O)c(c2)c(cc(O)c2)O1
M  END

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