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Mrv2104 06072104292D

11 11  0  0  0  0            999 V2000
   15.9429  -28.4988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9409  -29.3203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6600  -28.0860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6543  -29.7349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3714  -28.4970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2296  -28.0843    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3714  -29.3222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2274  -29.7309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.7962  -28.4974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0829  -28.0830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5110  -28.0850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  2  0  0  0  0
  8  2  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7  4  1  0  0  0  0
  9 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 — 18 of approximately 18 results

PHUB001321 Score: 1.0	3'-Hydroxytyrosol 10597-60-1 precursor metabolite	C₈H₁₀O₃ Mono mass: 154.062994182
PHUB001698 Score: 1.0	Hydroxytyrosol 10597-60-1 precursor	C₈H₁₀O₃ Mono mass: 154.062994182
PHUB002609 Score: 0.902	2-(3-hydroxyphenyl)-ethanol metabolite	C₈H₁₀O₂ Mono mass: 138.068079562
PHUB000538 Score: 0.882	4-Ethylcatechol precursor metabolite	C₈H₁₀O₂ Mono mass: 138.068079562
PHUB001440 Score: 0.85	Homovanillyl alcohol 2380-78-1 precursor	C₉H₁₂O₃ Mono mass: 168.078644246
PHUB001371 Score: 0.824	Tyrosol 501-94-0 precursor metabolite	C₈H₁₀O₂ Mono mass: 138.068079562
PHUB000527 Score: 0.81	3',4'-Dihydroxyphenylacetic acid 102-32-9 precursor metabolite	C₈H₈O₄ Mono mass: 168.042258738
PHUB001669 Score: 0.797	3,4-Dihydroxyphenylglycol precursor	C₈H₁₀O₄ Mono mass: 170.057908802
PHUB002105 Score: 0.789	test2	C₉H₁₂O₂ Mono mass: 152.083729626
PHUB000775 Score: 0.78	Dopamine precursor	C₈H₁₁NO₂ Mono mass: 153.078978598
PHUB000539 Score: 0.767	4-Ethylguaiacol precursor	C₉H₁₂O₂ Mono mass: 152.083729626
PHUB001789 Score: 0.754	2-(-3-Hydroxy-4-methylphenyl)propan-1-ol metabolite	C₁₀H₁₄O₂ Mono mass: 166.099379691
PHUB001048 Score: 0.746	3'-Hydroxyphenylacetic acid 621-37-4 metabolite	C₈H₈O₃ Mono mass: 152.047344118
PHUB000544 Score: 0.745	4-Methylcatechol precursor metabolite	C₇H₈O₂ Mono mass: 124.052429498
PHUB002805 Score: 0.729	3’-hydroxy-4’-methoxyphenylacetic acid metabolite	C₉H₁₀O₄ Mono mass: 182.057908802
PHUB000540 Score: 0.725	4-Ethylphenol metabolite	C₈H₁₀O Mono mass: 122.073164942
PHUB001500 Score: 0.717	Lunularine metabolite	C₁₄H₁₄O₂ Mono mass: 214.099379691
PHUB001561 Score: 0.714	Dihydro-piceatannol precursor	C₁₄H₁₄O₄ Mono mass: 246.089208931
PHUB000617 Score: 0.708	Homovanillic acid 306-08-1 precursor metabolite	C₉H₁₀O₄ Mono mass: 182.057908802
PHUB001920 Score: 0.708	3'-Methoxy-4'-hydroxyphenylacetic acid metabolite	C₉H₁₀O₄ Mono mass: 182.057908802