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Mrv2104 06072104322D

27 29  0  0  1  0            999 V2000
   -1.7497    1.1484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5782    0.3416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7936    0.0866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1805    0.6387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3520    1.4456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6042    0.3837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7756   -0.4232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1626   -0.9753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3341   -1.7823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1187   -2.0372    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.3737   -2.8218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1987   -2.8218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4535   -2.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2382   -1.7823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7862   -1.5523    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.1911   -0.8335    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3812   -0.8335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8011   -0.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3960    0.5953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8161    1.3055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4111    2.0242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5862    2.0328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6410    1.2968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0610    2.0069    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0461    0.5780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6261   -0.1320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6220   -0.7203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10  9  1  6  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 15 13  1  0  0  0  0
 10 15  1  0  0  0  0
 15 16  1  6  0  0  0
 15 17  1  1  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 20 23  2  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 25 26  2  0  0  0  0
 18 26  1  0  0  0  0
  8 27  2  0  0  0  0
  3 27  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 — 14 of approximately 14 results

PHUB001730 Score: 1.0	Nortrachelogenin precursor	C₂₀H₂₂O₇ Mono mass: 374.136553048
PHUB001388 Score: 0.843	(+)-Matairesinol precursor	C₂₀H₂₂O₆ Mono mass: 358.141638428
PHUB001720 Score: 0.837	Arctigenin precursor	C₂₁H₂₄O₆ Mono mass: 372.157288493
PHUB001723 Score: 0.837	Dimethylmatairesinol precursor	C₂₂H₂₆O₆ Mono mass: 386.172938557
PHUB001696 Score: 0.816	7-Hydroxymatairesinol precursor	C₂₀H₂₂O₇ Mono mass: 374.136553048
PHUB001726 Score: 0.755	Isohydroxymatairesinol precursor	C₂₀H₂₂O₇ Mono mass: 374.136553048
PHUB001387 Score: 0.746	Enterolactone metabolite	C₁₈H₁₈O₄ Mono mass: 298.12050906
PHUB002457 Score: 0.74	5-Dihydrocaffeoylquinic acid metabolite	C₁₆H₂₀O₉ Mono mass: 356.110732224
PHUB002606 Score: 0.74	Dihydrochlorogenic acid metabolite	C₁₆H₂₀O₉ Mono mass: 356.110732224
PHUB001718 Score: 0.739	7-Oxomatairesinol precursor	C₂₀H₂₀O₇ Mono mass: 372.120902984
PHUB002453 Score: 0.732	5-Dihydroferuloylquinic acid metabolite	C₁₈H₂₄O₈ Mono mass: 368.147117733
PHUB001691 Score: 0.729	1-Acetoxypinoresinol precursor	C₂₂H₂₄O₈ Mono mass: 416.147117733
PHUB001721 Score: 0.713	Conidendrin precursor	C₂₀H₂₀O₆ Mono mass: 356.125988364
PHUB002145 Score: 0.706	5-(4′-Hydroxyphenyl)-γ-valerolactone-3′-methoxy metabolite	C₁₂H₁₄O₄ Mono mass: 222.089208931
PHUB002776 Score: 0.706	5-(4'-Hydroxy-3'-methoxyphenyl)-γ-valerolactone metabolite	C₁₂H₁₄O₄ Mono mass: 222.089208931