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Mrv2104 06072104313D

28 29  0  0  0  0            999 V2000
    0.0170   -1.6666   -2.0787 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7130   -1.4895    0.2383 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2154   -0.8662   -1.6553 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2862    0.9600   -0.9914 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5931    0.2106   -1.9593 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1924   -0.9715    1.9646 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2541   -0.4166   -0.4395 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4383    0.4012    0.0558 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.0746   -0.5588    1.0152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0539    0.0235   -0.5582 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.3402    1.8275   -0.4120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7405    1.0213    0.3419 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.7253    1.5286    1.3433 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.8244    0.3951    1.7861 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.4050   -1.0899    0.9858 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2059   -0.6194    0.6084 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.0466   -0.0917    0.5699 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.9821   -0.0354   -1.9273 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3774    2.1511    0.7963 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3322    2.3024   -1.2515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8606    0.5212    0.9677 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9238    2.5342    0.8313 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5147   -0.6209    2.4131 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6865   -1.9310    1.9238 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4349   -0.8571    0.1186 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8702   -0.4698    1.9048 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6828    0.2672   -0.5974 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7494    0.3740    0.5680 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  2 25  1  0  0  0  0
  3  7  2  0  0  0  0
  8  4  1  6  0  0  0
  4 11  1  0  0  0  0
 10  5  1  6  0  0  0
  5 18  1  0  0  0  0
  6  9  2  0  0  0  0
  6 26  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  8  9  1  0  0  0  0
  9 15  1  0  0  0  0
 10 12  1  0  0  0  0
 10 27  1  0  0  0  0
 11 19  2  0  0  0  0
 11 20  1  0  0  0  0
 12 13  1  0  0  0  0
 12 21  1  1  0  0  0
 13 14  1  0  0  0  0
 13 22  1  6  0  0  0
 14 17  1  0  0  0  0
 14 23  1  6  0  0  0
 15 24  2  0  0  0  0
 15 25  1  0  0  0  0
 16 26  1  0  0  0  0
 16 28  1  6  0  0  0
 17 27  1  0  0  0  0
 17 28  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 — 8 of approximately 8 results

PHUB001683 Score: 1.0	Oleoside 11-methylester precursor	C₁₇H₂₄O₁₁ Mono mass: 404.131861593
PHUB001684 Score: 1.0	Oleoside dimethylester precursor	C₁₈H₂₆O₁₁ Mono mass: 418.147511657
PHUB001694 Score: 0.852	Ligstroside precursor	C₂₅H₃₂O₁₂ Mono mass: 524.18937647
PHUB000074 Score: 0.834	Oleuropein 32619-42-4 precursor	C₂₅H₃₂O₁₃ Mono mass: 540.18429109
PHUB001675 Score: 0.829	Demethyloleuropein precursor	C₂₄H₃₀O₁₃ Mono mass: 526.168641026
PHUB000065 Score: 0.788	Monotropein precursor	C₁₆H₂₂O₁₁ Mono mass: 390.116211528
PHUB000066 Score: 0.75	Monotropein (6,7-dihydro-) precursor	C₁₆H₂₄O₁₁ Mono mass: 392.131861593
PHUB000041 Score: 0.727	Gentiopicrin precursor	C₁₆H₂₀O₉ Mono mass: 356.110732224