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Mrv2104 06072104292D

23 25  0  0  0  0            999 V2000
   28.1094  -14.6419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   30.2529  -17.5294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   33.1243  -18.3830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.5942  -15.8595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.5384  -13.8169    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.6819  -15.8794    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.6819  -18.3544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.3950  -15.0544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.9673  -17.1169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.9673  -16.2919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.6819  -17.5294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.1338  -17.5580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.8813  -16.2748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.5384  -14.6419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.8240  -15.0544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.3963  -16.2919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.2529  -15.8794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.3963  -17.1169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.8813  -17.1341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.1338  -15.8508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.2529  -15.0544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.8240  -15.8794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.5384  -16.2919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 15  1  0  0  0  0
  2  9  1  0  0  0  0
  3 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5 14  1  0  0  0  0
  6 10  1  0  0  0  0
  6 16  1  0  0  0  0
  7 11  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
 12 18  2  0  0  0  0
 12 19  1  0  0  0  0
 13 19  2  0  0  0  0
 13 20  1  0  0  0  0
 14 15  2  0  0  0  0
 14 21  1  0  0  0  0
 15 22  1  0  0  0  0
 16 18  1  0  0  0  0
 16 20  2  0  0  0  0
 17 21  2  0  0  0  0
 17 23  1  0  0  0  0
 22 23  2  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 93 results

PHUB001146 Score: 1.0	Tamarixetin metabolite	C₁₆H₁₄O₇ Mono mass: 318.073952791
PHUB001756 Score: 1.0	Taxifolin 480-18-2 precursor	C₁₅H₁₂O₇ Mono mass: 304.058302726
PHUB001762 Score: 1.0	Dihydroquercetin precursor	C₁₅H₁₂O₇ Mono mass: 304.058302726
PHUB000400 Score: 0.925	Garbanzol precursor	C₁₅H₁₂O₅ Mono mass: 272.068473486
PHUB000378 Score: 0.907	Eriodictyol precursor metabolite	C₁₅H₁₂O₆ Mono mass: 288.063388106
PHUB000380 Score: 0.907	Hesperetin 520-33-2 precursor metabolite	C₁₆H₁₄O₆ Mono mass: 302.079038171
PHUB000399 Score: 0.901	Butin precursor	C₁₅H₁₂O₅ Mono mass: 272.068473486
PHUB001105 Score: 0.896	Homoeriodictyol metabolite	C₁₆H₁₄O₆ Mono mass: 302.079038171
PHUB000261 Score: 0.845	(+)-Catechin 154-23-4 precursor	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB000262 Score: 0.845	(-)-Epicatechin 490-46-0 precursor metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB000264 Score: 0.845	(-)-Epigallocatechin precursor	C₁₅H₁₄O₇ Mono mass: 306.073952791
PHUB000268 Score: 0.845	(+)-Gallocatechin precursor	C₁₅H₁₄O₇ Mono mass: 306.073952791
PHUB000382 Score: 0.845	Isosakuranetin precursor	C₁₆H₁₄O₅ Mono mass: 286.084123551
PHUB000387 Score: 0.845	Naringenin precursor metabolite	C₁₅H₁₂O₅ Mono mass: 272.068473486
PHUB001241 Score: 0.845	(Epi)catechin metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB002189 Score: 0.845	(−)-Gallocatechin precursor metabolite	C₁₅H₁₄O₇ Mono mass: 306.073952791
PHUB002190 Score: 0.845	(−)-Catechin precursor metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB002207 Score: 0.845	(+)-Epicatechin precursor metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB000398 Score: 0.84	Sakuranetin precursor	C₁₆H₁₄O₅ Mono mass: 286.084123551
PHUB000386 Score: 0.839	Liquiritigenin precursor	C₁₅H₁₂O₄ Mono mass: 256.073558866
PHUB000396 Score: 0.839	Pinocembrin precursor	C₁₅H₁₂O₄ Mono mass: 256.073558866
PHUB001747 Score: 0.834	3'-O-Methyl-epicatechin metabolite	C₁₆H₁₆O₆ Mono mass: 304.094688235
PHUB002215 Score: 0.834	3'-Methoxy-(+)-catechin metabolite	C₁₆H₁₆O₆ Mono mass: 304.094688235
PHUB001878 Score: 0.8	Cerasinone 64166-14-9 precursor	C₁₈H₁₈O₆ Mono mass: 330.1103383
PHUB001765 Score: 0.798	Glepidotin B precursor	C₂₀H₂₀O₅ Mono mass: 340.131073744
PHUB000402 Score: 0.788	Eriodictyol-6-C-glucoside precursor	C₂₁H₂₂O₁₁ Mono mass: 450.116211528
PHUB001761 Score: 0.785	Dihydromyricetin 3-O-rhamnoside precursor	C₂₁H₂₂O₁₂ Mono mass: 466.111126148
PHUB001763 Score: 0.785	Dihydroquercetin 3-O-rhamnoside precursor	C₂₁H₂₂O₁₁ Mono mass: 450.116211528
PHUB002141 Score: 0.785	Hesperetin-7-sulfate metabolite	C₁₆H₁₄O₉S Mono mass: 382.035853205
PHUB000403 Score: 0.776	Eriodictyol-8-C-glucoside precursor	C₂₁H₂₂O₁₁ Mono mass: 450.116211528
PHUB000375 Score: 0.772	Betagarin precursor	C₁₈H₁₆O₆ Mono mass: 328.094688235