Mol:PBX00055

 
 OpenBabel10130914012D 
 
 17 18  0  0  0  0  0  0  0  0999 V2000 
    3.4770   -7.9795    0.0000 C   0  0  0  0  0 
    3.4770   -9.3094    0.0000 C   0  0  0  0  0 
    2.3233   -7.3225    0.0000 C   0  0  0  0  0 
    2.3233   -9.9823    0.0000 C   0  0  0  0  0 
    1.1857   -8.0115    0.0000 C   0  0  0  0  0 
    1.1857   -9.3414    0.0000 C   0  0  0  0  0 
    2.3233   -6.0246    0.0000 C   0  0  0  0  0 
    3.4770   -5.3517    0.0000 C   0  0  0  0  0 
    3.4770   -4.0218    0.0000 C   0  0  0  0  0 
    2.3233   -3.3488    0.0000 C   0  0  0  0  0 
    2.3233   -2.0189    0.0000 C   0  0  0  0  0 
    3.4770   -1.3459    0.0000 C   0  0  0  0  0 
    4.6306   -2.0029    0.0000 C   0  0  0  0  0 
    4.6306   -3.3328    0.0000 C   0  0  0  0  0 
    0.0000   -9.9823    0.0000 O   0  0  0  0  0 
    4.6146   -9.9823    0.0000 O   0  0  0  0  0 
    3.4770    0.0000    0.0000 O   0  0  0  0  0 
  1  2  1  0  0  0 
  1  3  2  0  0  0 
  2  4  2  0  0  0 
  2 16  1  0  0  0 
  3  5  1  0  0  0 
  3  7  1  0  0  0 
  4  6  1  0  0  0 
  5  6  2  0  0  0 
  6 15  1  0  0  0 
  7  8  2  0  0  0 
  8  9  1  0  0  0 
  9 10  2  0  0  0 
  9 14  1  0  0  0 
 10 11  1  0  0  0 
 11 12  2  0  0  0 
 12 13  1  0  0  0 
 12 17  1  0  0  0 
 13 14  2  0  0  0 
S  SKP  6 
NAME	Resveratrol 
ID	PBX00055 
FORMULA	C14H12O3 
EXACTMASS	228.07864425 
AVERAGEMASS	228.24328 
SMILES	Oc(c2)ccc(c2)C=Cc(c1)cc(O)cc(O)1 
M  END