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Licoisoflavone A
  Mrv2104 06072104202D

26 28  0  0  0  0            999 V2000
   -0.7029   -0.4170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0117   -0.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4208   -0.8258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6994    0.4074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7260   -0.4239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0048   -1.6571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1354   -0.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4243   -1.6501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4140    0.8265    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4407   -0.8361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7260    0.4039    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7192   -2.0761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1319    0.4143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8395   -0.8224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4372   -1.6639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1551   -0.4274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8395    0.8299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5574   -0.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8395   -1.6468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1483   -2.0796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8662   -0.8429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5574    0.4143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5841   -0.4341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2719    0.8299    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2986   -0.8498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5875    0.3902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  2  0  0  0  0
  7 14  1  0  0  0  0
  9 13  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 12 15  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  2  0  0  0  0
 14 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
 17 22  2  0  0  0  0
 18 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  1  0  0  0  0
 23 25  1  0  0  0  0
 23 26  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 — 11 of approximately 11 results

PHUB000229 Score: 1.0	Licoisoflavone A precursor	C₂₀H₁₈O₆ Mono mass: 354.1103383
PHUB001358 Score: 0.818	2'-Hydroxydaidzein precursor	C₁₅H₁₀O₅ Mono mass: 270.052823422
PHUB000225 Score: 0.755	Genistein precursor metabolite	C₁₅H₁₀O₅ Mono mass: 270.052823422
PHUB000220 Score: 0.742	Biochanin A precursor	C₁₆H₁₂O₅ Mono mass: 284.068473486
PHUB000230 Score: 0.731	Prunetin precursor	C₁₆H₁₂O₅ Mono mass: 284.068473486
PHUB002600 Score: 0.724	8-hydroxy-genistein metabolite	C₁₅H₁₀O₆ Mono mass: 286.047738042
PHUB002598 Score: 0.72	3'-Hydroxygenistein metabolite	C₁₅H₁₀O₆ Mono mass: 286.047738042
PHUB002599 Score: 0.72	6-Hydroxygenistein metabolite	C₁₅H₁₀O₆ Mono mass: 286.047738042
PHUB000222 Score: 0.711	Daidzein precursor metabolite	C₁₅H₁₀O₄ Mono mass: 254.057908802
PHUB000224 Score: 0.706	Formononetin precursor	C₁₆H₁₂O₄ Mono mass: 268.073558866
PHUB003035 Score: 0.701	Pratensein 2284-31-3 precursor	C₁₆H₁₂O₆ Mono mass: 300.063388106