Mol:FL5F19NP0001

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FL5F19NP0001.png

 
 
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 25 28  0  0  0  0  0  0  0  0999 V2000 
   -1.4014   -0.0706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4014   -0.7130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8451   -1.0342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2888   -0.7130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2888   -0.0706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8451    0.2505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2675   -1.0342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8238   -0.7130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8238   -0.0706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2675    0.2505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2675   -1.5350    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3799    0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9469   -0.0769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5138    0.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5138    0.9051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9469    1.2324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3799    0.9051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8451    0.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4014    1.2141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9577    0.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9577    0.2505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5138    1.2140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9577    1.5350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6898   -1.2130    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5558   -1.7130    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  5  1  0  0  0  0 
  7 11  2  0  0  0  0 
  9 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 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 12  1  0  0  0  0 
  6 18  1  0  0  0  0 
 18 19  2  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21  1  1  0  0  0  0 
 20 22  1  0  0  0  0 
 20 23  1  0  0  0  0 
  8 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  SVB   1 27    1.0226   -0.9193 
S  SKP  8 
ID	FL5F19NP0001 
KNApSAcK_ID	C00005072 
NAME	Karanjachromene;Pongaflavone;3-Methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one 
CAS_RN	38070-93-8 
FORMULA	C21H18O4 
EXACTMASS	334.120509064 
AVERAGEMASS	334.36521999999997 
SMILES	COC(C(=O)2)=C(Oc(c34)c2ccc(OC(C=C4)(C)C)3)c(c1)cccc1 
M  END
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