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Mrv2104 01272310492D

20 22  0  0  0  0            999 V2000
   -0.7145    0.2061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.6186    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4290    0.6186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4290   -1.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.2061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1436    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.8564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1436   -0.6186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4290   -1.8564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8580    0.6188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8580   -1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1436    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290    1.4439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8580    0.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1436    1.8564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8580    1.4438    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
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
 11 15  1  0  0  0  0
 13 16  2  0  0  0  0
 13 17  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
  7  9  2  0  0  0  0
  8 11  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 63 results

PHUB000868 Score: 1.0	Baicalein precursor	C₁₅H₁₀O₅ Mono mass: 270.052823422
PHUB000905 Score: 0.985	Scutellarein precursor	C₁₅H₁₀O₆ Mono mass: 286.047738042
PHUB000857 Score: 0.934	6-Hydroxyluteolin precursor	C₁₅H₁₀O₇ Mono mass: 302.042652662
PHUB000870 Score: 0.93	Chrysin precursor	C₁₅H₁₀O₄ Mono mass: 254.057908802
PHUB000886 Score: 0.928	Hispidulin precursor	C₁₆H₁₂O₆ Mono mass: 300.063388106
PHUB000861 Score: 0.915	Apigenin 520-36-5 precursor metabolite	C₁₅H₁₀O₅ Mono mass: 270.052823422
PHUB000879 Score: 0.889	Cirsimaritin precursor	C₁₇H₁₄O₆ Mono mass: 314.079038171
PHUB000892 Score: 0.883	Luteolin 491-70-3 precursor	C₁₅H₁₀O₆ Mono mass: 286.047738042
PHUB000900 Score: 0.883	Nepetin precursor	C₁₆H₁₂O₇ Mono mass: 316.058302726
PHUB000658 Score: 0.879	Galangin precursor	C₁₅H₁₀O₅ Mono mass: 270.052823422
PHUB000908 Score: 0.871	Tetramethylscutellarein precursor	C₁₉H₁₈O₆ Mono mass: 342.1103383
PHUB000860 Score: 0.869	7,4'-Dihydroxyflavone precursor	C₁₅H₁₀O₄ Mono mass: 254.057908802
PHUB000672 Score: 0.867	Kaempferol precursor	C₁₅H₁₀O₆ Mono mass: 286.047738042
PHUB000890 Score: 0.865	Jaceosidin precursor	C₁₇H₁₄O₇ Mono mass: 330.073952791
PHUB001880 Score: 0.862	Tectochrysin 520-28-5 precursor	C₁₆H₁₂O₄ Mono mass: 268.073558866
PHUB000652 Score: 0.859	6,8-Dihydroxykaempferol precursor	C₁₅H₁₀O₈ Mono mass: 318.037567282
PHUB000882 Score: 0.859	Eupatilin precursor	C₁₈H₁₆O₇ Mono mass: 344.089602855
PHUB002780 Score: 0.859	Herbacetin 527-95-7 precursor	C₁₅H₁₀O₇ Mono mass: 302.042652662
PHUB000878 Score: 0.853	Cirsiliol precursor	C₁₇H₁₄O₇ Mono mass: 330.073952791
PHUB000883 Score: 0.853	Eupatorin precursor	C₁₈H₁₆O₇ Mono mass: 344.089602855
PHUB002994 Score: 0.853	5,3′-didemethylsinensetin metabolite	C₁₈H₁₆O₇ Mono mass: 344.089602855
PHUB000862 Score: 0.85	Apigenin 7,4'-dimethyl ether precursor	C₁₇H₁₄O₅ Mono mass: 298.084123551
PHUB001876 Score: 0.848	Betuletol 35214-88-1 precursor	C₁₇H₁₄O₇ Mono mass: 330.073952791
PHUB000859 Score: 0.847	7,3',4'-Trihydroxyflavone precursor	C₁₅H₁₀O₅ Mono mass: 270.052823422
PHUB000880 Score: 0.846	Diosmetin precursor	C₁₆H₁₂O₆ Mono mass: 300.063388106
PHUB000872 Score: 0.844	Chrysin 5,7-dimethyl ether precursor	C₁₇H₁₄O₄ Mono mass: 282.089208931
PHUB000671 Score: 0.838	Kaempferide precursor	C₁₆H₁₁O₆ Mono mass: 299.056111654
PHUB000693 Score: 0.838	Morin precursor	C₁₅H₁₀O₇ Mono mass: 302.042652662
PHUB000877 Score: 0.837	Cirsilineol precursor	C₁₈H₁₆O₇ Mono mass: 344.089602855
PHUB002995 Score: 0.837	5,4′-didemethylsinensetin metabolite	C₁₈H₁₆O₇ Mono mass: 344.089602855
PHUB000694 Score: 0.833	Myricetin precursor	C₁₅H₁₀O₈ Mono mass: 318.037567282
PHUB000702 Score: 0.833	Quercetin 117-39-5 precursor metabolite	C₁₅H₁₀O₇ Mono mass: 302.042652662