Mol:FL1C1ANI0006

<pre>

Copyright: ARM project http://www.metabolome.jp/
 27 28  0  0  0  0  0  0  0  0999 V2000
    1.7328    0.9574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7328    0.3150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2891   -0.0062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8455    0.3150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8455    0.9574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2891    1.2786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4759    0.3150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0322   -0.0062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0802   -0.0060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6412    0.3276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0802   -0.6468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7478   -0.9478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8504   -0.9478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4018   -0.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.6038    2.4504    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
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
  2  8  1  0  0  0  0
 10 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 10  1  0  0  0  0
 17  5  1  0  0  0  0
 15 18  1  0  0  0  0
 19 16  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 21 25  1  0  0  0  0
 14 26  1  0  0  0  0
 26 27  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  26  27
M  SBL   1  1  27
M  SMT   1  OCH3
M  SVB   1 27   -2.1037    1.5844
S  SKP  8
ID	FL1C1ANI0006
KNApSAcK_ID	C00007066
NAME	Xanthoangelol E
CAS_RN	132998-84-6
FORMULA	C21H22O6
EXACTMASS	370.141638436
AVERAGEMASS	370.39578
SMILES	Oc(c2)ccc(c2)C=CC(c(c1O)ccc(c1CC(OO)C(C)=C)OC)=O
M  END

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