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Lubimin
  Mrv2104 06072104192D

17 18  0  0  0  0            999 V2000
    6.4642   -1.7176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7497   -2.9551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9324   -2.6195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1787   -2.9552    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.2650   -3.7756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844   -3.2327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0719   -3.9470    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.1787   -2.1301    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.7497   -2.1301    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.4643   -3.3676    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.4643   -4.1926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0352   -1.7176    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8932   -1.7176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8932   -0.8926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8730   -5.4585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2855   -4.7440    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1104   -4.7439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  4  8  1  0  0  0  0
  4 10  1  0  0  0  0
  8  1  1  0  0  0  0
  1  9  1  0  0  0  0
  9  2  1  0  0  0  0
  2 10  1  0  0  0  0
  4  3  1  6  0  0  0
  3  6  1  0  0  0  0
  4  5  1  1  0  0  0
  5  7  1  0  0  0  0
  7  6  1  0  0  0  0
  7 16  1  1  0  0  0
  8 13  1  6  0  0  0
  9 12  1  6  0  0  0
 10 11  1  6  0  0  0
 13 14  2  0  0  0  0
 16 15  2  0  0  0  0
 16 17  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 — 8 of approximately 8 results

PHUB000136 Score: 1.0	Lubimin precursor	C₁₅H₂₄O₂ Mono mass: 236.177630013
PHUB000163 Score: 0.758	Betulinic acid precursor	C₃₀H₄₈O₃ Mono mass: 456.360345406
PHUB000959 Score: 0.755	6-exo-Hydroxycamphene metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000165 Score: 0.746	Colubrinic acid precursor	C₃₀H₄₆O₄ Mono mass: 470.339609961
PHUB002044 Score: 0.734	Steviol 471-80-7 precursor metabolite	C₂₀H₃₀O₃ Mono mass: 318.219494826
PHUB000003 Score: 0.731	Atractyligenin 10391-47-6 precursor	C₁₉H₂₈O₄ Mono mass: 320.198759382
PHUB000960 Score: 0.727	7-Hydroxycamphene metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001782 Score: 0.709	5-endo-Hydroxycamphor 13948-58-8 metabolite	C₁₀H₁₆O₂ Mono mass: 168.115029755
PHUB001783 Score: 0.709	5-exo-Hydroxycamphor precursor metabolite	C₁₀H₁₆O₂ Mono mass: 168.115029755