Mol:FL1D1CNS0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 21 23  0  0  0  0  0  0  0  0999 V2000 
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   -0.7360   -0.3199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1835   -0.0009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3679   -0.3192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9180   -0.0015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4564   -0.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9948   -0.0015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9948    0.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4564    0.9310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9180    0.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7360   -0.9579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.5860   -0.1936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9514    0.3093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5860    0.8122    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 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 
  3 18  1  0  0  0  0 
 12 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21 13  1  0  0  0  0 
S  SKP  8 
ID	FL1D1CNS0003 
KNApSAcK_ID	C00007953 
NAME	2',4'-Dihydroxy-3,4-methylenedioxydihydrochalcone 
CAS_RN	- 
FORMULA	C16H14O5 
EXACTMASS	286.084123558 
AVERAGEMASS	286.27936 
SMILES	Oc(c3)cc(O)c(c3)C(=O)CCc(c1)cc(O2)c(OC2)c1 
M  END