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p-Methoxycinnamaldehyde
  Mrv2104 06072104312D

12 12  0  0  0  0            999 V2000
    2.7216   -2.2688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2927    2.6812    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7216    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7216   -1.4438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4362   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0072   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4362   -1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0072   -1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7216    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0072    1.4438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4362   -2.6812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0072    2.2688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1 11  1  0  0  0  0
  2 12  2  0  0  0  0
  3  5  2  0  0  0  0
  3  6  1  0  0  0  0
  3  9  1  0  0  0  0
  4  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  2  0  0  0  0
  9 10  2  0  0  0  0
 10 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 — 14 of approximately 14 results

PHUB001704 Score: 1.0	p-Methoxycinnamaldehyde precursor	C₁₀H₁₀O₂ Mono mass: 162.068079562
PHUB000050 Score: 0.893	Isoestragole precursor	C₁₀H₁₂O Mono mass: 148.088815006
PHUB000566 Score: 0.893	Anethole precursor	C₁₀H₁₂O Mono mass: 148.088815006
PHUB000607 Score: 0.824	Ferulaldehyde precursor	C₁₀H₁₀O₃ Mono mass: 178.062994182
PHUB002710 Score: 0.818	Cassiastearoptene 60125-24-8 / 1504-74-1 precursor	C₁₀H₁₀O₂ Mono mass: 162.068079562
PHUB000590 Score: 0.758	Coumaric acid (p-) 501-98-4 precursor metabolite	C₉H₈O₃ Mono mass: 164.047344118
PHUB000637 Score: 0.757	Sinapaldehyde 4206-58-0 precursor	C₁₁H₁₂O₄ Mono mass: 208.073558866
PHUB000523 Score: 0.746	2-Methoxy-5-prop-1-enylphenol precursor	C₁₀H₁₂O₂ Mono mass: 164.083729626
PHUB000621 Score: 0.735	Isoeugenol precursor	C₁₀H₁₂O₂ Mono mass: 164.083729626
PHUB000622 Score: 0.727	Isoferulic acid 537-73-5 metabolite	C₁₀H₁₀O₄ Mono mass: 194.057908802
PHUB001887 Score: 0.718	Methyl p-Coumaric acid 3943-97-3 precursor metabolite	C₁₀H₁₀O₃ Mono mass: 178.062994182
PHUB000608 Score: 0.718	Ferulic acid 537-98-4 precursor metabolite	C₁₀H₁₀O₄ Mono mass: 194.057908802
PHUB000548 Score: 0.714	4-Vinylphenol precursor	C₈H₈O Mono mass: 120.057514878
PHUB000233 Score: 0.71	4-Hydroxycoumarin precursor	C₉H₁₀O₂ Mono mass: 150.068079562
PHUB001516 Score: 0.704	Mono-demethylated pterostilbene metabolite	C₁₅H₁₄O₃ Mono mass: 242.094294311
PHUB001523 Score: 0.704	Pinostilbene metabolite	C₁₅H₁₄O₃ Mono mass: 242.094294311