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Mrv2104 06072104292D

26 28  0  0  0  0            999 V2000
10001.3653 9997.9192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.0792 9998.3327    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.1027 9997.9192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.673710000.3933    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.388210000.8080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.2446 9999.5692    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.347510001.5797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10001.493310002.0707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10003.775310000.7543    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.2459 9999.5988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9999.5785 9999.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9999.8334 9998.3292    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10000.6584 9998.3292    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
10000.9133 9999.1138    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
 9997.6736 9999.5699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.9592 9999.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9996.9592 9998.3323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.6736 9997.9198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.3881 9998.3323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.3881 9999.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10003.060610000.3416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.346110000.7540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.631610000.3415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.6316 9999.5165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.3460 9999.1040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10003.0606 9999.5166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  4  5  1  0  0  0  0
  7  8  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 14  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 15  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 21  1  0  0  0  0
 22  7  1  0  0  0  0
 21  9  1  0  0  0  0
 13  1  1  1  0  0  0
 14 24  1  6  0  0  0
 12  3  1  1  0  0  0
  3 19  1  0  0  0  0
 15  4  1  0  0  0  0
 16  6  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 — 18 of approximately 18 results

PHUB001390 Score: 1.0	(+)-Lariciresinol precursor	C₂₀H₂₄O₆ Mono mass: 360.157288493
PHUB001389 Score: 0.983	(+)-Pinoresinol precursor	C₂₀H₂₂O₆ Mono mass: 358.141638428
PHUB001729 Score: 0.935	Medioresinol precursor	C₂₁H₂₄O₇ Mono mass: 388.152203113
PHUB001737 Score: 0.935	Syringaresinol precursor	C₂₂H₂₆O₈ Mono mass: 418.162767797
PHUB001724 Score: 0.913	Episesamin precursor	C₂₀H₁₈O₆ Mono mass: 354.1103383
PHUB001732 Score: 0.913	Sesamin precursor	C₂₀H₁₈O₆ Mono mass: 354.1103383
PHUB001738 Score: 0.887	Todolactol A precursor	C₂₀H₂₄O₇ Mono mass: 376.152203113
PHUB001739 Score: 0.887	Trachelogenin precursor	C₂₀H₂₄O₇ Mono mass: 376.152203113
PHUB001697 Score: 0.853	7-Hydroxysecoisolariciresinol precursor	C₂₀H₂₆O₇ Mono mass: 378.167853177
PHUB001728 Score: 0.817	Lariciresinol-sesquilignan precursor	C₃₀H₃₆O₁₀ Mono mass: 556.230847359
PHUB001726 Score: 0.8	Isohydroxymatairesinol precursor	C₂₀H₂₂O₇ Mono mass: 374.136553048
PHUB001696 Score: 0.791	7-Hydroxymatairesinol precursor	C₂₀H₂₂O₇ Mono mass: 374.136553048
PHUB001725 Score: 0.789	Episesaminol precursor	C₂₀H₁₈O₇ Mono mass: 370.10525292
PHUB001733 Score: 0.789	Sesaminol precursor	C₂₀H₁₈O₇ Mono mass: 370.10525292
PHUB001719 Score: 0.776	Anhydro-secoisolariciresinol precursor	C₂₀H₂₄O₅ Mono mass: 344.162373873
PHUB001691 Score: 0.758	1-Acetoxypinoresinol precursor	C₂₂H₂₄O₈ Mono mass: 416.147117733
PHUB001735 Score: 0.734	Sesamolin precursor	C₂₀H₁₈O₇ Mono mass: 370.10525292
PHUB001736 Score: 0.734	Sesamolinol precursor	C₂₀H₂₀O₇ Mono mass: 372.120902984
PHUB001731 Score: 0.711	Secoisolariciresinol-sesquilignan precursor	C₃₀H₃₈O₁₀ Mono mass: 558.246497424
PHUB001385 Score: 0.707	Secoisolariciresinol precursor	C₂₀H₂₆O₆ Mono mass: 362.172938557