Mol:FL5F1CNF0001

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FL5F1CNF0001.png

 
 
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 25 29  0  0  0  0  0  0  0  0999 V2000 
   -2.2227    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2227   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6664   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1101   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1101    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6664    0.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5538   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0025   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0025    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5538    0.4018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5538   -1.3837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5586    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1256    0.0744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6926    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6926    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1256    1.3837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5586    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7999    1.0301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4388    1.0973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7000    0.5105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3152    0.1994    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7000    0.7290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3152    1.2587    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8685   -1.0617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7346   -1.5616    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  1  1  0  0  0  0 
 14 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 23 15  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  28 
M  SMT   1  OCH3 
M  SVB   1 28    0.2014    -0.768 
S  SKP  8 
ID	FL5F1CNF0001 
KNApSAcK_ID	C00005092 
NAME	Pongapin;3-Methoxy-2-[3,4-(methylenedioxy)phenyl]-4H-furo[2,3-h]-1-benzopyran-4-one;2-(1,3-Benzodioxol-5-yl)-3-methoxy-4H-furo[2,3-h]-1-benzopyran-4-one 
CAS_RN	481-99-2 
FORMULA	C19H12O6 
EXACTMASS	336.063388116 
AVERAGEMASS	336.29498 
SMILES	c(c51)(OCO5)ccc(C(O4)=C(C(c(c43)ccc(c32)occ2)=O)OC)c1 
M  END
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