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Mrv2104 06072104312D

16 18  0  0  0  0            999 V2000
   -0.2076    0.4493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2049   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0299   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4423    0.4493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0299    1.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2049    1.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2674    0.4493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6799   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5049   -0.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9174    0.4493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5049    1.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6799    1.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2674   -0.9797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6799   -1.6941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4423   -0.9797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9174    1.8782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  1  6  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
  3 15  1  0  0  0  0
 11 16  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 — 30 of approximately 42 results

PHUB001649 Score: 1.0	Isourolithin B metabolite	C₁₃H₈O₃ Mono mass: 212.047344118
PHUB001647 Score: 0.952	Isourolithin A 174023-48-4 metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001394 Score: 0.928	Urolithin B 1139-83-9 metabolite	C₁₃H₈O₃ Mono mass: 212.047344118
PHUB001947 Score: 0.919	8,9-Dihydroxyurolithin metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001948 Score: 0.917	Urolithin BR metabolite	C₁₃H₈O₃ Mono mass: 212.047344118
PHUB001946 Score: 0.898	9,10-Dihydroxyurolithin metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001941 Score: 0.888	Isourolithin AR metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001391 Score: 0.886	Urolithin A 1143-70-0 metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001396 Score: 0.878	Urolithin C 165393-06-6 metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB001938 Score: 0.868	8,9,10-Trihydroxyurolithin metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB000250 Score: 0.867	Umbelliferone precursor metabolite	C₉H₆O₃ Mono mass: 162.031694053
PHUB001943 Score: 0.867	3,10-Dihydroxyurolithin metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001942 Score: 0.865	8,10-Dihydroxyurolithin metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001935 Score: 0.859	isourolithin C metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB000239 Score: 0.841	Esculetin precursor	C₉H₆O₄ Mono mass: 178.026608673
PHUB001931 Score: 0.839	Urolithin M7 531512-26-2 metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB001927 Score: 0.832	Urolithin M6 1006683-97-1 metabolite	C₁₃H₈O₆ Mono mass: 260.032087978
PHUB001932 Score: 0.832	Urolithin CR metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB001936 Score: 0.832	3,4,9-Trihydroxyurolithin metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB001940 Score: 0.828	Urolithin AR metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001945 Score: 0.821	3,4-Dihydroxyurolithin metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001934 Score: 0.806	4,9,10-Trihydroxyurolithin metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB001944 Score: 0.802	4,10-Dihydroxyurolithin metabolite	C₁₃H₈O₄ Mono mass: 228.042258738
PHUB001398 Score: 0.798	Urolithin D 131086-98-1 metabolite	C₁₃H₈O₆ Mono mass: 260.032087978
PHUB000257 Score: 0.791	Herniarin precursor	C₁₀H₈O₃ Mono mass: 176.047344118
PHUB001929 Score: 0.79	Urolithin M6R metabolite	C₁₃H₈O₆ Mono mass: 260.032087978
PHUB001937 Score: 0.788	Urolithin G metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB001933 Score: 0.786	Urolithin M7R metabolite	C₁₃H₈O₅ Mono mass: 244.037173358
PHUB000246 Score: 0.779	Scopoletin precursor	C₁₀H₈O₄ Mono mass: 192.042258738
PHUB000259 Score: 0.776	Bergaptol precursor	C₁₁H₆O₄ Mono mass: 202.026608673