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Mrv2104 06072104222D

55 57  0  0  0  0            999 V2000
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  1 31  1  0  0  0  0
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  5 35  1  0  0  0  0
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  7 37  1  0  0  0  0
  8 38  1  0  0  0  0
  9 38  1  0  0  0  0
 10 39  1  0  0  0  0
 11 42  1  0  0  0  0
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 11 17  1  0  0  0  0
 12 43  1  0  0  0  0
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 15 23  1  0  0  0  0
 15 27  1  0  0  0  0
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 21 50  1  0  0  0  0
 21 33  2  0  0  0  0
 22 51  1  0  0  0  0
 22 34  2  0  0  0  0
 23 35  1  0  0  0  0
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 24 25  2  0  0  0  0
 24 33  1  0  0  0  0
 25 53  1  0  0  0  0
 25 36  1  0  0  0  0
 26 54  1  0  0  0  0
 26 30  2  0  0  0  0
 26 34  1  0  0  0  0
 27 37  1  0  0  0  0
 28 38  1  0  0  0  0
 29 39  1  0  0  0  0
 30 55  1  0  0  0  0
 30 40  1  0  0  0  0
 35 36  2  0  0  0  0
 36 37  1  0  0  0  0
 38 40  1  0  0  0  0
 39 40  1  0  0  0  0
 39 41  1  0  0  0  0
 40 41  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
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 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

PHUB000348 Score: 1.0	Carotene 5,6-epoxide (beta-) precursor	C₄₀H₅₆O Mono mass: 552.433116423
PHUB000343 Score: 0.905	Antheraxanthin 640-03-9 precursor	C₄₀H₅₆O₃ Mono mass: 584.422945663
PHUB000369 Score: 0.9	Violaxanthin precursor	C₄₀H₅₆O₄ Mono mass: 600.417860283
PHUB000362 Score: 0.888	Lutein 5,6-epoxide precursor	C₄₀H₅₆O₃ Mono mass: 584.422945663
PHUB000365 Score: 0.771	Mutatochrome precursor	C₄₀H₅₆O Mono mass: 552.433116423
PHUB000358 Score: 0.741	Flavoxanthin precursor	C₄₀H₅₆O₃ Mono mass: 584.422945663
PHUB000366 Score: 0.736	Neoxanthin precursor	C₄₀H₅₆O₄ Mono mass: 600.417860283
PHUB000150 Score: 0.71	Theaspirane precursor	C₁₃H₂₂O Mono mass: 194.167065328