Mol:FLIE1ANI0004

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 28  0  0  0  0  0  0  0  0999 V2000
   -2.0044   -0.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0044   -0.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4481   -1.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8918   -0.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8918   -0.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4481    0.1942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3355   -1.0905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2208   -0.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2208   -0.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3355    0.1942    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7769   -1.0904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7769   -1.7772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3717   -2.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9665   -1.7772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9665   -1.0904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3717   -0.7470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7769    0.1941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3338   -1.7770    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5607    0.1942    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5607   -2.1203    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4481    0.8363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0042    1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0042    1.7995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5603    2.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4481    2.1206    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  2  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
  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
  9 17  2  0  0  0  0
  7 18  1  0  0  0  0
 19  1  1  0  0  0  0
 12 18  1  0  0  0  0
 14 20  1  0  0  0  0
  6 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
S  SKP  8
ID	FLIE1ANI0004
KNApSAcK_ID	C00010051
NAME	Phaseol;3,9-Dihydroxy-4-prenylcoumestan
CAS_RN	88478-02-8
FORMULA	C20H16O5
EXACTMASS	336.099773622
AVERAGEMASS	336.33804000000003
SMILES	C(c(c4O)c(c3cc4)OC(c(c32)c(c1)c(o2)cc(O)c1)=O)C=C(C)C
M  END

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