Mol:FL5FALNS0006

<pre>

Copyright: ARM project http://www.metabolome.jp/
 26 28  0  0  0  0  0  0  0  0999 V2000
   -2.4197   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4197   -0.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8634   -1.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3070   -0.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3070   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8634    0.1452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7507   -1.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1944   -0.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1944   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7507    0.1452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7507   -1.6403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3617    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9286   -0.1822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4956    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4956    0.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9286    1.1271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3617    0.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8634   -1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9286    1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2052    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7769    0.4428    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2768    1.3089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0624    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7769    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6716   -1.3183    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5377   -1.8182    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
  3 18  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
 15 23  1  0  0  0  0
 23 24  1  0  0  0  0
  8 25  1  0  0  0  0
 25 26  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  25  26
M  SBL   3  1  27
M  SMT   3  OCH3
M  SVB   3 27    0.0044   -1.0246
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  23  24
M  SBL   2  1  25
M  SMT   2  OCH3
M  SVB   2 25    2.0624     1.127
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  21  22
M  SBL   1  1  23
M  SMT   1  OCH3
M  SVB   1 23   -2.7769    0.4428
S  SKP  8
ID	FL5FALNS0006
KNApSAcK_ID	C00004747
NAME	Apuleidin
CAS_RN	34318-36-0
FORMULA	C18H16O8
EXACTMASS	360.08451748799996
AVERAGEMASS	360.31484
SMILES	c(c1O)(O)c(OC)ccc1C(O2)=C(C(c(c(O)3)c2cc(OC)c3)=O)OC
M  END

</pre>