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Caffeic acid 4-O-glucoside
  Mrv2104 06072104242D

24 25  0  0  0  0            999 V2000
    0.0893   -6.7547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0893   -5.9297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8038   -5.5172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8038   -4.6922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5183   -4.2797    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5182   -3.4547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2327   -3.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2327   -2.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5183   -1.8047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9472   -1.8047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6616   -2.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3761   -1.8047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0906   -2.2172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8051   -1.8047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8051   -0.9797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5196   -2.2172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6617   -3.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9472   -3.4547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2327   -4.6922    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.9472   -4.2797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2328   -5.5172    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9472   -5.9297    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5183   -5.9297    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.5182   -6.7547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 11 17  1  0  0  0  0
 17 18  2  0  0  0  0
  7 18  1  0  0  0  0
  5 19  1  0  0  0  0
 19 21  1  0  0  0  0
 21 23  1  0  0  0  0
  3 23  1  0  0  0  0
 12 11  1  0  0  0  0
  5  6  1  1  0  0  0
  2  3  1  1  0  0  0
 21 22  1  1  0  0  0
 19 20  1  6  0  0  0
 23 24  1  6  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 95 results

PHUB000575 Score: 1.0	Caffeic acid 4-O-glucoside precursor	C₁₅H₁₈O₉ Mono mass: 342.09508216
PHUB000609 Score: 0.987	Ferulic acid-4'-O-glucoside precursor	C₁₆H₂₀O₉ Mono mass: 356.110732224
PHUB000591 Score: 0.89	Coumaric acid-4'-O-glucoside precursor	C₁₅H₁₈O₈ Mono mass: 326.10016754
PHUB002777 Score: 0.885	Linocinnamarin 554-87-0 precursor	C₁₆H₂₀O₈ Mono mass: 340.115817604
PHUB001917 Score: 0.88	caffeic acid-4'-O-glucuronide metabolite	C₁₅H₁₆O₁₀ Mono mass: 356.074346715
PHUB001170 Score: 0.87	Ferulic acid-4'-O-glucuronide 86321-24-6 metabolite	C₁₆H₁₈O₁₀ Mono mass: 370.08999678
PHUB001916 Score: 0.865	caffeic acid-3'-O-glucuronide metabolite	C₁₅H₁₆O₁₀ Mono mass: 356.074346715
PHUB001432 Score: 0.86	Isoferulic acid-3'-O-glucuronide 1065272-10-7 metabolite	C₁₆H₁₈O₁₀ Mono mass: 370.08999678
PHUB002709 Score: 0.86	Ferulic acid-3-glucuronide metabolite	C₁₆H₁₈O₁₀ Mono mass: 370.08999678
PHUB002773 Score: 0.848	Linusitamarin 152574-10-2 precursor	C₁₇H₂₂O₉ Mono mass: 370.126382288
PHUB001543 Score: 0.822	rhapontin precursor	C₂₁H₂₄O₉ Mono mass: 420.142032353
PHUB001573 Score: 0.822	Rhaponticin precursor	C₂₁H₂₄O₉ Mono mass: 420.142032353
PHUB000339 Score: 0.816	Resveratrol 4'-glucoside precursor	C₂₀H₂₂O₈ Mono mass: 390.131467668
PHUB001506 Score: 0.816	Resveratroloside metabolite	C₂₀H₂₂O₈ Mono mass: 390.131467668
PHUB000321 Score: 0.81	Piceatannol 3-O-glucoside precursor	C₂₀H₂₂O₉ Mono mass: 406.126382288
PHUB001520 Score: 0.801	Mono-hydroxylated pterostilbene glucuronide metabolite	C₂₂H₂₄O₁₀ Mono mass: 448.136946973
PHUB000325 Score: 0.798	Piceid (trans-) precursor metabolite	C₂₀H₂₂O₈ Mono mass: 390.131467668
PHUB000326 Score: 0.798	Resveratrol 5-O-glucoside precursor	C₂₀H₂₂O₈ Mono mass: 390.131467668
PHUB000334 Score: 0.798	Piceid (cis-) precursor metabolite	C₂₀H₂₂O₈ Mono mass: 390.131467668
PHUB001542 Score: 0.798	Deoxyrhapontin precursor	C₂₁H₂₄O₈ Mono mass: 404.147117733
PHUB001538 Score: 0.797	trans-rhapontigenin-3'-O-β-d-glucuronide metabolite	C₂₁H₂₂O₁₀ Mono mass: 434.121296908
PHUB000311 Score: 0.796	Protocatechuic acid 4-O-glucoside precursor	C₁₃H₁₆O₉ Mono mass: 316.079432095
PHUB001493 Score: 0.793	5-methoxyresveratrol-3-O-β-glucoside metabolite	C₂₁H₂₄O₈ Mono mass: 404.147117733
PHUB001539 Score: 0.792	rhapontin-3'-glucuronide metabolite	C₂₇H₃₂O₁₅ Mono mass: 596.17412033
PHUB001194 Score: 0.792	Coumaric acid-3'-glucuronide metabolite	C₁₅H₁₆O₉ Mono mass: 340.079432095
PHUB001198 Score: 0.789	Coumaric acid-4'-O-glucuronide metabolite	C₁₅H₁₆O₉ Mono mass: 340.079432095
PHUB001550 Score: 0.788	Oxyresveratrol-4-O-β-D-glucoside metabolite	C₂₀H₂₂O₉ Mono mass: 406.126382288
PHUB000305 Score: 0.782	Gallic acid 4-O-glucoside precursor	C₁₃H₁₆O₁₀ Mono mass: 332.074346715
PHUB001549 Score: 0.778	Mulberroside A precursor	C₂₆H₃₂O₁₄ Mono mass: 568.17920571
PHUB001551 Score: 0.778	Oxyresveratrol 3′-O-β-D-glucoside metabolite	C₂₀H₂₂O₉ Mono mass: 406.126382288
PHUB001409 Score: 0.765	Curcumin glucuronide metabolite	C₂₇H₂₈O₁₂ Mono mass: 544.158076342
PHUB002719 Score: 0.762	Rosmarinic acid-4-glucuronide metabolite	C₂₄H₂₄O₁₄ Mono mass: 536.116605453