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Garbanzol
  Mrv2104 06072104222D

20 22  0  0  1  0            999 V2000
   14.2837   -9.6755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7004  -11.3321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2701  -12.1520    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4231   -9.6721    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8545   -8.4577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9904  -10.0939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5635  -10.9137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5669  -10.0871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9869  -10.9205    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.2734  -11.3252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7072   -9.6824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8534   -9.6755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8534  -11.3219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1365  -10.0871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1365  -10.9137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4173  -10.1008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7106   -8.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1343   -9.6927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4242   -8.4543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1376   -8.8659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  1  8  1  0  0  0  0
  9  2  1  1  0  0  0
  3 10  2  0  0  0  0
  4 14  1  0  0  0  0
  5 20  1  0  0  0  0
  6  9  1  0  0  0  0
  6 11  1  0  0  0  0
  7  8  2  0  0  0  0
  7 10  1  0  0  0  0
  7 13  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  1  0  0  0  0
 11 16  2  0  0  0  0
 11 17  1  0  0  0  0
 12 14  2  0  0  0  0
 13 15  2  0  0  0  0
 14 15  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  2  0  0  0  0
 18 20  2  0  0  0  0
 19 20  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 58 results

PHUB000400 Score: 1.0	Garbanzol precursor	C₁₅H₁₂O₅ Mono mass: 272.068473486
PHUB001146 Score: 0.925	Tamarixetin metabolite	C₁₆H₁₄O₇ Mono mass: 318.073952791
PHUB001756 Score: 0.925	Taxifolin 480-18-2 precursor	C₁₅H₁₂O₇ Mono mass: 304.058302726
PHUB001762 Score: 0.925	Dihydroquercetin precursor	C₁₅H₁₂O₇ Mono mass: 304.058302726
PHUB000386 Score: 0.906	Liquiritigenin precursor	C₁₅H₁₂O₄ Mono mass: 256.073558866
PHUB000382 Score: 0.9	Isosakuranetin precursor	C₁₆H₁₄O₅ Mono mass: 286.084123551
PHUB000387 Score: 0.9	Naringenin precursor metabolite	C₁₅H₁₂O₅ Mono mass: 272.068473486
PHUB000398 Score: 0.894	Sakuranetin precursor	C₁₆H₁₄O₅ Mono mass: 286.084123551
PHUB000396 Score: 0.893	Pinocembrin precursor	C₁₅H₁₂O₄ Mono mass: 256.073558866
PHUB000399 Score: 0.849	Butin precursor	C₁₅H₁₂O₅ Mono mass: 272.068473486
PHUB001878 Score: 0.849	Cerasinone 64166-14-9 precursor	C₁₈H₁₈O₆ Mono mass: 330.1103383
PHUB000378 Score: 0.844	Eriodictyol precursor metabolite	C₁₅H₁₂O₆ Mono mass: 288.063388106
PHUB000380 Score: 0.844	Hesperetin 520-33-2 precursor metabolite	C₁₆H₁₄O₆ Mono mass: 302.079038171
PHUB001105 Score: 0.833	Homoeriodictyol metabolite	C₁₆H₁₄O₆ Mono mass: 302.079038171
PHUB001765 Score: 0.831	Glepidotin B precursor	C₂₀H₂₀O₅ Mono mass: 340.131073744
PHUB000270 Score: 0.82	Afzelechin precursor	C₁₅H₁₄O₅ Mono mass: 274.084123551
PHUB002144 Score: 0.785	Naringenin-4'-sulfate metabolite	C₁₅H₁₂O₈S Mono mass: 352.02528852
PHUB000372 Score: 0.771	6-Prenylnaringenin 68236-13-5 precursor metabolite	C₂₀H₂₀O₅ Mono mass: 340.131073744
PHUB002143 Score: 0.771	Naringenin-7- sulfate metabolite	C₁₅H₁₂O₈S Mono mass: 352.02528852
PHUB000261 Score: 0.77	(+)-Catechin 154-23-4 precursor	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB000262 Score: 0.77	(-)-Epicatechin 490-46-0 precursor metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB000264 Score: 0.77	(-)-Epigallocatechin precursor	C₁₅H₁₄O₇ Mono mass: 306.073952791
PHUB000268 Score: 0.77	(+)-Gallocatechin precursor	C₁₅H₁₄O₇ Mono mass: 306.073952791
PHUB001241 Score: 0.77	(Epi)catechin metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB002189 Score: 0.77	(−)-Gallocatechin precursor metabolite	C₁₅H₁₄O₇ Mono mass: 306.073952791
PHUB002190 Score: 0.77	(−)-Catechin precursor metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB002207 Score: 0.77	(+)-Epicatechin precursor metabolite	C₁₅H₁₄O₆ Mono mass: 290.079038171
PHUB000373 Score: 0.763	8-Prenylnaringenin precursor metabolite	C₂₀H₂₀O₅ Mono mass: 340.131073744
PHUB000374 Score: 0.763	6,8-Diprenylnaringenin precursor	C₂₅H₂₈O₅ Mono mass: 408.193674002
PHUB001747 Score: 0.761	3'-O-Methyl-epicatechin metabolite	C₁₆H₁₆O₆ Mono mass: 304.094688235
PHUB002215 Score: 0.761	3'-Methoxy-(+)-catechin metabolite	C₁₆H₁₆O₆ Mono mass: 304.094688235