Mol:PR100637

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PR100637.png

 
  ISISHOST03240423252D 1   1.00000     0.00000  9250 
 
 19 21  0     0  0            999 V2000 
   -1.0552    0.1345    0.0000 C   0  0  0  0  0  0           0  0  0 
   -1.0517    0.9655    0.0000 C   0  0  0  0  0  0           0  0  0 
   -0.3379   -0.2793    0.0000 C   0  0  0  0  0  0           0  0  0 
   -1.7690   -0.2759    0.0000 C   0  0  0  0  0  0           0  0  0 
   -0.3310    1.3793    0.0000 O   0  0  0  0  0  0           0  0  0 
   -1.7690    1.3828    0.0000 C   0  0  0  0  0  0           0  0  0 
    0.3759    0.1310    0.0000 C   0  0  0  0  0  0           0  0  0 
   -0.3414   -1.1103    0.0000 O   0  0  0  0  0  0           0  0  0 
   -2.4897    0.1345    0.0000 C   0  0  0  0  0  0           0  0  0 
    0.3793    0.9586    0.0000 C   0  0  0  0  0  0           0  0  0 
   -2.4897    0.9655    0.0000 C   0  0  0  0  0  0           0  0  0 
    1.0931   -0.2862    0.0000 C   0  0  0  0  0  0           0  0  0 
   -3.2069    1.3828    0.0000 O   0  0  0  0  0  0           0  0  0 
    1.0862   -1.1138    0.0000 C   0  0  0  0  0  0           0  0  0 
    1.8103    0.1241    0.0000 C   0  0  0  0  0  0           0  0  0 
    1.8035   -1.5345    0.0000 C   0  0  0  0  0  0           0  0  0 
    2.5276   -0.2897    0.0000 C   0  0  0  0  0  0           0  0  0 
    2.5241   -1.1207    0.0000 C   0  0  0  0  0  0           0  0  0 
    3.2414   -1.5414    0.0000 O   0  0  0  0  0  0           0  0  0 
  1  2  2  0     0  0 
  1  3  1  0     0  0 
  1  4  1  0     0  0 
  2  5  1  0     0  0 
  2  6  1  0     0  0 
  3  7  1  0     0  0 
  3  8  2  0     0  0 
  4  9  2  0     0  0 
  5 10  1  0     0  0 
  6 11  2  0     0  0 
  7 12  1  0     0  0 
 11 13  1  0     0  0 
 12 14  2  0     0  0 
 12 15  1  0     0  0 
 14 16  1  0     0  0 
 15 17  2  0     0  0 
 16 18  2  0     0  0 
 18 19  1  0     0  0 
  7 10  2  0     0  0 
  9 11  1  0     0  0 
 17 18  1  0     0  0 
S  SKP  7 
CAS_RN	486-66-8 
NAME	Daidzein 
ID	PR100637 
FORMULA	C15H10O4 
EXACTMASS	254.05790880799998 
AVERAGEMASS	254.2375 
SMILES	Oc(c3)ccc(c3)C(=C1)C(=O)c(c2)c(cc(O)c2)O1 
M  END
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