Mol:FL2FALNI0041

<pre>

Copyright: ARM project http://www.metabolome.jp/
 33 35  0  0  0  0  0  0  0  0999 V2000
   -1.4675   -0.4786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4490   -1.2824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6718   -1.6676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0170   -1.2665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0028   -0.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7285   -0.0166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7380   -1.6920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4118   -1.2911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4025   -0.4247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7187   -0.0415    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1170   -0.0122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8081   -0.3987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5195   -0.0002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5399    0.8246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8282    1.2543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1078    0.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7380   -2.4337    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1820   -0.0661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6718   -2.5177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1630    1.1843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4429    1.2802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4429    2.1052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7285    2.5177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1574    2.5177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7285    0.8677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8081   -1.1336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4052   -1.4783    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1539    0.8698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8231    1.2562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4860    0.8735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4860    0.1408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1630    1.2643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1626    0.4829    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  1  1  0  0  0  0
  4  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  5  1  0  0  0  0
  9 11  1  6  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
  3 19  1  0  0  0  0
 14 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
  6 25  1  0  0  0  0
 25 21  1  0  0  0  0
 12 26  1  0  0  0  0
 26 27  1  0  0  0  0
 21 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  1  0  0  0  0
 30 33  1  0  0  0  0
S  SKP  8
ID	FL2FALNI0041
KNApSAcK_ID	C00014204
NAME	Kushenol P;(2S)-5,7,4'-Trihydroxy-2'-methoxy-8-(5-hydroxy-5-methyl-2-isopropenylhexyl)flavanone
CAS_RN	254886-69-6
FORMULA	C26H32O7
EXACTMASS	456.214803378
AVERAGEMASS	456.52807999999993
SMILES	c(c3)(OC)c(ccc3O)C(O1)CC(c(c2O)c1c(c(O)c2)CC(CCC(C)(C)O)C(C)=C)=O
M  END

</pre>