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Mrv2104 06072104352D

29 33  0  0  1  0            999 V2000
   20.7963  -10.8159    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   21.0136  -11.6117    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   21.3768  -10.2298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8115  -11.8214    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   22.1747  -10.4395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3920  -11.2353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3612  -11.2178    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   19.6349  -12.0159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9856  -10.5881    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   20.4370  -12.2147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3498  -10.1786    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   18.9072  -10.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9355   -9.5422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7740   -9.7343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5368  -11.5682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9385  -10.9373    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   17.5413  -11.6604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3735  -10.3362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6272  -10.6878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7308  -11.5061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9061  -11.5237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6621  -12.3282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5780  -10.0139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2140  -11.4090    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.0947  -10.0468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3770  -12.4220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.1396  -13.2121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.1799  -12.2326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6297  -12.6260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8 10  1  0  0  0  0
  9  1  1  0  0  0  0
 10  2  1  0  0  0  0
  1  2  1  0  0  0  0
 11 12  1  1  0  0  0
 11 13  1  0  0  0  0
  7 12  1  1  0  0  0
 13 14  1  0  0  0  0
  7  9  1  0  0  0  0
 14  9  1  0  0  0  0
  7 15  1  0  0  0  0
 11 16  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  6  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 17  1  0  0  0  0
  9 23  1  1  0  0  0
  2 24  1  1  0  0  0
  1 25  1  6  0  0  0
  4 26  1  6  0  0  0
 26 27  1  0  0  0  0
 26 28  2  0  0  0  0
  4 29  1  1  0  0  0
M  END

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(+)-Catechin
  Mrv1572001071604202D

21 23  0  0  1  0            999 V2000
    2.0414   -2.6714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3269   -2.2589    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6125   -2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1020   -2.2589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -3.4964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5310   -2.2589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5310   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2454   -1.0214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -1.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1020   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6125   -1.0214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3269   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0414   -1.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0414   -0.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7559    0.2161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4703   -0.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1848    0.2161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4703   -1.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7559   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1848   -1.4339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  4 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  2 13  1  0  0  0  0
 15 16  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 14 20  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 16 17  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 10 11  1  0  0  0  0
  8  7  1  0  0  0  0
  4  5  1  0  0  0  0
M  END

Results 1 — 2 of approximately 2 results

PHUB002058 Score: 1.0		20-nor-cofaryloside II precursor	C₂₃H₃₆O₅ Mono mass: 392.256274259
PHUB000004 Score: 0.748		Atractyligenin (2-O-beta-glucopyranosyl-) precursor	C₂₆H₄₀O₈ Mono mass: 480.272318248