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Mrv2104 09262209242D

58 63  0  0  0  0            999 V2000
  -11.0707   -0.5045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3563   -0.0920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  -11.0707   -1.3295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2128   -0.5045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4984   -0.0920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -8.2128    1.1454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9273    0.7329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0681    3.6204    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0681    1.9704    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  8 13  1  0  0  0  0
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 12  3  1  0  0  0  0
  6 17  1  0  0  0  0
 17 19  1  0  0  0  0
 10 20  2  0  0  0  0
 16 21  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  1  0  0  0  0
 14 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 25  1  1  0  0  0
 25 26  1  1  0  0  0
 26 27  1  1  0  0  0
 27 28  1  0  0  0  0
 23 24  1  0  0  0  0
 28 24  1  0  0  0  0
 25 29  1  0  0  0  0
 26 30  1  0  0  0  0
 31 32  1  0  0  0  0
 34 35  1  6  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 32  1  0  0  0  0
 32 33  1  1  0  0  0
 33 34  1  1  0  0  0
 37 38  1  0  0  0  0
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 46 47  1  0  0  0  0
 47 48  1  6  0  0  0
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  1 18  1  0  0  0  0
 18 55  1  0  0  0  0
 55 56  1  0  0  0  0
 55 57  2  0  0  0  0
 55 58  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
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  8  7  1  0  0  0  0
  4  5  1  0  0  0  0
M  END

Results 1 — 30 of approximately 77 results

PHUB002490 Score: 1.0	Hesperetin-O-glucosyl-sulfate metabolite	C₃₄H₄₄O₂₃S Mono mass: 852.199408851
PHUB000377 Score: 0.874	Eriocitrin precursor	C₂₇H₃₂O₁₅ Mono mass: 596.17412033
PHUB000381 Score: 0.874	Hesperidin precursor	C₂₈H₃₄O₁₅ Mono mass: 610.189770395
PHUB000394 Score: 0.871	Neoeriocitrin precursor	C₂₇H₃₂O₁₅ Mono mass: 596.17412033
PHUB000395 Score: 0.871	Neohesperidin precursor	C₂₈H₃₄O₁₅ Mono mass: 610.189770395
PHUB002835 Score: 0.869	Hesperetin-7-glucuronide-3’-sulfate metabolite	C₂₂H₂₂O₁₄S Mono mass: 542.073026562
PHUB000379 Score: 0.865	Eriodictyol 7-O-glucoside precursor	C₂₁H₂₂O₁₁ Mono mass: 450.116211528
PHUB002491 Score: 0.865	Hesperetin-7-O-glucoside precursor	C₂₂H₂₄O₁₁ Mono mass: 464.131861593
PHUB002832 Score: 0.864	Hesperetin-5-glucuronide-7-sulfate metabolite	C₂₂H₂₂O₁₄S Mono mass: 542.073026562
PHUB002827 Score: 0.858	Hesperetin-3’-sulfate-5,7-diglucuronide metabolite	C₂₈H₃₀O₂₀S Mono mass: 718.10511454
PHUB002831 Score: 0.858	Hesperetin-5-glucuronide-3’-sulfate metabolite	C₂₂H₂₂O₁₄S Mono mass: 542.073026562
PHUB002837 Score: 0.854	Hesperetin-7-sulfate-3’,5-diglucuronide metabolite	C₂₈H₃₀O₂₀S Mono mass: 718.10511454
PHUB002826 Score: 0.853	Hesperetin-3’-glucuronide-7-sulfate metabolite	C₂₂H₂₂O₁₄S Mono mass: 542.073026562
PHUB002830 Score: 0.851	Hesperetin-5-glucuronide-3’,7-di-sulfate metabolite	C₂₂H₂₂O₁₇S₂ Mono mass: 622.029841596
PHUB002834 Score: 0.851	Hesperetin-7-glucuronide-3’,5-di-sulfate metabolite	C₂₂H₂₂O₁₇S₂ Mono mass: 622.029841596
PHUB002836 Score: 0.843	Hesperetin-7-glucuronide-5-sulfate metabolite	C₂₂H₂₂O₁₄S Mono mass: 542.073026562
PHUB000376 Score: 0.839	Didymin precursor	C₂₈H₃₄O₁₄ Mono mass: 594.194855775
PHUB000392 Score: 0.839	Narirutin 14259-46-2 precursor	C₂₇H₃₂O₁₄ Mono mass: 580.17920571
PHUB000393 Score: 0.839	Narirutin 4'-O-glucoside precursor	C₃₃H₄₂O₁₉ Mono mass: 742.232029132
PHUB000389 Score: 0.835	Naringin precursor	C₂₇H₃₂O₁₄ Mono mass: 580.17920571
PHUB000397 Score: 0.835	Poncirin precursor	C₂₈H₃₄O₁₄ Mono mass: 594.194855775
PHUB000383 Score: 0.83	Isosakuranin precursor	C₂₂H₂₄O₁₀ Mono mass: 448.136946973
PHUB000388 Score: 0.83	Prunin precursor	C₂₁H₂₂O₁₀ Mono mass: 434.121296908
PHUB001595 Score: 0.83	Naringenin-7-glucoside 529-55-5 precursor	C₂₁H₂₂O₁₀ Mono mass: 434.121296908
PHUB002833 Score: 0.827	Hesperetin-5-sulfate-3’,7-diglucuronide metabolite	C₂₈H₃₀O₂₀S Mono mass: 718.10511454
PHUB001905 Score: 0.823	Scorzocreticoside I 393510-25-3 precursor	C₂₈H₃₆O₁₅ Mono mass: 612.205420459
PHUB002824 Score: 0.823	Hesperetin-3’-glucuronide-5,7-di-sulfate metabolite	C₂₂H₂₂O₁₇S₂ Mono mass: 622.029841596
PHUB002825 Score: 0.823	Hesperetin-3’-glucuronide-5-sulfate metabolite	C₂₂H₂₂O₁₄S Mono mass: 542.073026562
PHUB000390 Score: 0.821	Naringenin 4'-O-glucoside precursor	C₂₁H₂₂O₁₀ Mono mass: 434.121296908
PHUB001081 Score: 0.819	Eriodictyol-7-glucuronide metabolite	C₂₁H₂₀O₁₂ Mono mass: 464.095476084