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Mrv2104 06072104352D

14 13  0  0  0  0            999 V2000
    1.2556    1.2188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9700    0.8063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0312    1.2188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7457    0.8063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3168    0.8063    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.3168   -0.0187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6023    1.2188    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.6023    2.0438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5411    0.8063    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5411   -0.0187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8878    0.8063    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.8878   -0.0187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1734    1.2188    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1734    2.0438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  5  1  0  0  0  0
  5  7  1  0  0  0  0
  7 11  1  0  0  0  0
 11 13  1  0  0  0  0
 13  9  1  0  0  0  0
  9  1  1  0  0  0  0
  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  1  0  0  0
  7  8  1  1  0  0  0
  9 10  1  1  0  0  0
 11 12  1  6  0  0  0
 13 14  1  6  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 — 3 of approximately 3 results

PHUB001956 Score: 1.0	Perseitol 527-06-0 precursor	C₇H₁₆O₇ Mono mass: 212.089602855
PHUB002329 Score: 0.96	Rhamnitol 488-28-8 precursor	C₆H₁₄O₅ Mono mass: 166.084123551
PHUB001870 Score: 0.889	Myo-inositol 87-89-8 precursor	C₆H₁₂O₆ Mono mass: 180.063388106