Mol:LBST04020007

<pre>

Copyright: ARM project http://www.metabolome.jp/
 30 33  0  0  0  0  0  0  0  0999 V2000
    5.4641    4.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    5.0304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7321    4.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    3.5304    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.5981    3.0304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4641    3.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    3.0304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    2.0304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7321    1.5304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.5981    2.0304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7321    0.5304    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.5981    0.0304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4641    0.5304    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4641    1.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9889   -0.1388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3956   -1.0523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3902   -0.9478    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4641    2.5304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.4696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0593   -1.6909    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.0374   -1.4830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7503   -2.6420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4194   -3.3851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1104   -4.3362    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.7795   -5.0793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4705   -6.0304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    6.0304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.5304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1322   -4.5441    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    0.0304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  6  0  0  0
  1  6  1  0  0  0  0
  4  7  1  1  0  0  0
  7  8  1  0  0  0  0
  9  8  1  6  0  0  0
  9 10  1  0  0  0  0
  5 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 10 14  1  1  0  0  0
 15 16  1  0  0  0  0
 17 16  1  1  0  0  0
 12 17  1  6  0  0  0
 11 15  1  1  0  0  0
  5 18  1  1  0  0  0
 12 19  1  1  0  0  0
 17 20  1  0  0  0  0
 20 21  1  6  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
  2 27  1  6  0  0  0
  8 28  1  6  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 24 29  1  4  0  0  0
 13 30  1  6  0  0  0
S  SKP  5
ID	LBST04020007
FORMULA	C26H46O4
EXACTMASS	422.33960995999996
AVERAGEMASS	422.6410399999999
SMILES	C[C@]([C@@H]([C@@H](CCC(O)CC)C)4)([C@H]3O)[C@@H](CC4)[C@@H]([C@H](C3)1)[C@@H](C[C@@H](C2)[C@](CC[C@H]2O)1C)O
M  END

</pre>