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Mrv2104 09302318022D

12 12  0  0  0  0            999 V2000
   10.3298   -6.8184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3298   -7.6435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6154   -6.4059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6154   -8.0560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9009   -6.8184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9009   -7.6435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6154   -5.5809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6154   -8.8810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9009   -9.2935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3298   -9.2935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3298  -10.1185    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3298   -5.1684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  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
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
  7 12  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 — 16 of approximately 16 results

PHUB003071 Score: 1.0	p-menthane-7,9-diol metabolite	C₁₀H₁₈O₂ Mono mass: 170.13067982
PHUB001027 Score: 0.885	Myrtenol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000075 Score: 0.865	Perillyl alcohol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001022 Score: 0.865	(-)-Perillyl alcohol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000993 Score: 0.846	Limonene-10-ol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000966 Score: 0.811	3-Carene-9-ol metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001026 Score: 0.77	Verbenol (trans-) metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001824 Score: 0.77	Verbenol (cis-) 13040-03-4 metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000090 Score: 0.764	Terpineol-alpha precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB003063 Score: 0.762	Z-4-Hydroxymyrtenol metabolite	C₁₀H₁₆O₂ Mono mass: 168.115029755
PHUB003064 Score: 0.762	E-4-Hydroxymyrtenol metabolite	C₁₀H₁₆O₂ Mono mass: 168.115029755
PHUB000991 Score: 0.754	Limonene-8,9-diol metabolite	C₁₀H₁₈O₂ Mono mass: 170.13067982
PHUB002075 Score: 0.754	Akhdarenol precursor	C₂₀H₃₂O Mono mass: 288.24531565
PHUB000970 Score: 0.742	Carveol 99-48-9 / 2102-58-1 metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000108 Score: 0.717	Cadinol precursor	C₁₅H₂₆O Mono mass: 222.198365457
PHUB002077 Score: 0.712	Amyrin-(beta) 559-70-6 precursor	C₃₀H₅₀O Mono mass: 426.38616623