Mol:PR100936

 
  ISISHOST03240423072D 1   1.00000     0.00000  2732 
 
 13 14  0     0  0            999 V2000 
    0.0655    0.1621    0.0000 C   0  0  0  0  0  0           0  0  0 
    0.0655   -0.6690    0.0000 C   0  0  0  0  0  0           0  0  0 
   -0.6552    0.5828    0.0000 C   0  0  0  0  0  0           0  0  0 
    0.7897    0.5828    0.0000 O   0  0  0  0  0  0           0  0  0 
   -0.6552   -1.0759    0.0000 C   0  0  0  0  0  0           0  0  0 
    0.7862   -1.0931    0.0000 C   0  0  0  0  0  0           0  0  0 
   -1.3655    0.1621    0.0000 C   0  0  0  0  0  0           0  0  0 
   -0.6586    1.4069    0.0000 O   0  0  0  0  0  0           0  0  0 
    1.4310    0.1483    0.0000 C   0  0  0  0  0  0           0  0  0 
   -1.3655   -0.6690    0.0000 C   0  0  0  0  0  0           0  0  0 
    1.4276   -0.6897    0.0000 C   0  0  0  0  0  0           0  0  0 
   -2.0759    0.5759    0.0000 O   0  0  0  0  0  0           0  0  0 
    2.2241    0.5793    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  2  0     0  0 
  3  8  1  0     0  0 
  4  9  1  0     0  0 
  5 10  2  0     0  0 
  6 11  2  0     0  0 
  7 12  1  0     0  0 
  9 13  2  0     0  0 
  7 10  1  0     0  0 
  9 11  1  0     0  0 
S  SKP  7 
CAS_RN	486-35-1 
NAME	Daphnetin 
ID	PR100936 
FORMULA	C9H6O4 
EXACTMASS	178.02660867999998 
AVERAGEMASS	178.14154 
SMILES	O=C(C=2)Oc(c(O)1)c(C2)ccc(O)1 
M  END