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3-Carene-9-ol
  Mrv2104 06072104282D

11 12  0  0  0  0            999 V2000
    3.5724    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    1.6500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2712    1.9333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1440    0.6416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3748   -0.1505    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  2  7  1  0  0  0  0
  6  8  1  1  0  0  0
  5  8  1  1  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  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 — 17 of approximately 17 results

PHUB000966 Score: 1.0	3-Carene-9-ol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB002075 Score: 0.786	Akhdarenol precursor	C₂₀H₃₂O Mono mass: 288.24531565
PHUB000993 Score: 0.778	Limonene-10-ol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000967 Score: 0.774	3-Carene-9-carboxylic acid metabolite	C₁₀H₁₄O₂ Mono mass: 166.099379691
PHUB000090 Score: 0.764	Terpineol-alpha precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000991 Score: 0.754	Limonene-8,9-diol metabolite	C₁₀H₁₈O₂ Mono mass: 170.13067982
PHUB001027 Score: 0.75	Myrtenol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000108 Score: 0.746	Cadinol precursor	C₁₅H₂₆O Mono mass: 222.198365457
PHUB002077 Score: 0.741	Amyrin-(beta) 559-70-6 precursor	C₃₀H₅₀O Mono mass: 426.38616623
PHUB000969 Score: 0.738	3-caren-10-ol-9-carboxylic acid metabolite	C₁₀H₁₄O₃ Mono mass: 182.094294311
PHUB001848 Score: 0.738	Limonene-8,9-epoxide	C₁₀H₁₆O Mono mass: 152.120115135
PHUB002627 Score: 0.738	8,9-epoxy-p-menth-1ene metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000030 Score: 0.72	Carene precursor	C₁₀H₁₆ Mono mass: 136.125200515
PHUB000166 Score: 0.717	Erythrodiol precursor	C₃₀H₅₀O₂ Mono mass: 442.38108085
PHUB000194 Score: 0.717	Uvaol precursor	C₃₀H₅₀O₂ Mono mass: 442.38108085
PHUB000968 Score: 0.716	3-carene-9,10-dicarboxylic acid metabolite	C₁₀H₁₂O₄ Mono mass: 196.073558866
PHUB000075 Score: 0.702	Perillyl alcohol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001022 Score: 0.702	Perillyl aldehyde metabolite 1 metabolite	C₁₀H₁₆O Mono mass: 152.120115135