Mol:FL1C2CNF0001

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FL1C2CNF0001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 28  0  0  0  0  0  0  0  0999 V2000
   -2.2339    0.2866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2339   -0.3557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6776   -0.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1213   -0.3557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1213    0.2866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6776    0.6078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5650   -0.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0087   -0.3557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5474   -0.6768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1035   -0.3557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6645   -0.6796    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2255   -0.3557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2255    0.2921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6645    0.6160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1035    0.2921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5650   -1.1782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8448    0.4851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2224   -0.0345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8448   -0.5542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8416   -0.5559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2224   -0.0318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8416    0.4922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6776    1.2499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1140   -0.8374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3995   -1.2499    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  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  7 16  2  0  0  0  0
  1 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19  2  1  0  0  0  0
 12 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 13  1  0  0  0  0
  6 23  1  0  0  0  0
  3 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  24  25
M  SBL   1  1  27
M  SMT   1 OCH3
M  SBV   1 27   -6.2962    3.4055
S  SKP  8
ID	FL1C2CNF0001
KNApSAcK_ID	C00007025
NAME	5'-Hydroxy-2'-methoxy-3,4-methylenedioxyfurano[2'',3'':4',3']chalcone
CAS_RN	61755-70-2
FORMULA	C19H14O6
EXACTMASS	338.07903818
AVERAGEMASS	338.31086000000005
SMILES	c(O4)(c1)c(OC4)ccc(C=CC(c(c3OC)cc(c(c32)occ2)O)=O)1
M  END

</pre>

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