Mol:FL1C1ANP0008

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FL1C1ANP0008.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 26 28  0  0  0  0  0  0  0  0999 V2000
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    3.5323   -0.7053    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3984   -1.2052    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
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 15 16  2  0  0  0  0
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  5 17  1  0  0  0  0
 15 18  1  0  0  0  0
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 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
  4 25  1  0  0  0  0
 25 26  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  25  26
M  SBL   1  1  27
M  SMT   1  OCH3
M  SVB   1 27    2.8651   -0.4116
S  SKP  8
ID	FL1C1ANP0008
KNApSAcK_ID	C00007094
NAME	Pongachalcone II
CAS_RN	64173-09-7
FORMULA	C21H20O5
EXACTMASS	352.13107375
AVERAGEMASS	352.3805
SMILES	c(c1C=CC(c(c3O)ccc(c32)OC(C=C2)(C)C)=O)c(c(O)cc1)OC
M  END

</pre>

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