LDB_84_Norepanorin -- LDB_84_Norepanorin

Return to experiment 200421_LDB_NEG_07
Resolver: mzspec:MS2LDA:TASK-1282:accession:1707385

Associated Mass2Motifs

The following table lists all Mass2Motifs that explain features extracted from this fragmentation spectra -- at the threshold specified in the experiment option.

Motif Probability Overlap Score Annotation
motif_51 1.000 0.633 29 spectra, 11 molecules, 4 classes: 72.7% Pulvinic Acid Derivatives, 9.1% Quinones, 9.1% Cleavage Products of Depsides and Depsidones, 9.1% Depsides (Tridepsides)

Fragmentation Spectrum Plot

The fragmentation spectrum of this molecule is plotted below, alongside associated Mass2Motifs. Features (fragments and losses) explained by the associated Mass2Motif are coloured in red, while the parent ion is coloured in blue.

Molecule Plot

Features

The following table lists all features extracted from this fragmentation spectra -- alongside Mass2Motifs that explain these features at the threshold specified in the experiment option. The column MAGMa Substructure Annotation shows substructures annotations from MAGMa. Hovering over each MAGMa substructure shows the plots of 10 random documents containing the substructure.

Name Intensity Mass2Motif (prob) MAGMa Substructure Annotation
fragment_263.0750 1000.0 motif_51 (1.000)
  • O=C1OC(=Cc2ccccc2)C(O)=C1c1ccccc1
fragment_442.1250 439.0 motif_51 (1.000)
fragment_248.0850 381.0 motif_51 (1.000)
  • OC1C(=Cc2ccccc2)OCC=1c1ccccc1
fragment_117.0350 114.0 motif_51 (1.000)
fragment_420.1450 85.0 motif_51 (1.000)
  • CC(C)CC(NC(=O)C(=C1OC(=O)C(c2ccccc2)=C1O)c1ccccc1)C(=O)O
fragment_247.0750 63.0 motif_51 (1.000)
  • O=C1OC(=Cc2ccccc2)C=C1c1ccccc1
fragment_376.1550 54.0 motif_51 (1.000)
  • CC(C)CCNC(=O)C(=C1OC(=O)C(=C1O)c1ccccc1)c1ccccc1
fragment_191.0850 47.0 motif_51 (1.000)
fragment_262.0650 29.0 motif_51 (1.000)
  • O=C1OC(=Cc2ccccc2)C(O)=C1c1ccccc1
fragment_203.0850 26.0 motif_51 (1.000)
  • C(C=Cc1ccccc1)=Cc1ccccc1
fragment_214.1250 26.0 motif_51 (1.000)
  • C=C(C(=O)NCCC(C)C)c1ccccc1
fragment_285.0550 26.0 motif_51 (1.000)
fragment_424.1150 18.0 motif_51 (1.000)
fragment_101.0350 15.0 motif_51 (1.000)
fragment_332.1650 13.0 motif_51 (1.000)
  • CC(C)CCNC(=O)C(=CC(O)=Cc1ccccc1)c1ccccc1
fragment_130.0850 11.0 motif_51 (1.000)
  • CC(C)CC(N)C(=O)O
fragment_91.9750 11.0 motif_51 (1.000)
fragment_157.0550 9.0 motif_51 (1.000)
  • CC=C(C(N)=O)c1ccccc1
fragment_832.2250 9.0 motif_51 (1.000)
loss_31.0550 9.0 motif_51 (1.000)
fragment_634.3450 9.0 motif_51 (1.000)
fragment_76.2950 8.0 motif_51 (1.000)
fragment_486.1850 8.0 motif_51 (1.000)
fragment_77.2550 7.0 motif_51 (1.000)
fragment_64.4250 7.0 motif_51 (1.000)
fragment_175.0950 7.0 motif_51 (1.000)
fragment_333.1550 7.0 motif_51 (1.000)
fragment_616.4250 6.0 motif_51 (1.000)
fragment_634.9350 6.0 motif_51 (1.000)
fragment_354.1450 5.0 motif_51 (1.000)
loss_139.4650 5.0 motif_51 (1.000)
fragment_525.3950 5.0 motif_51 (1.000)
fragment_607.6550 5.0 motif_51 (1.000)
fragment_606.3950 5.0 motif_51 (1.000)
fragment_723.8150 5.0 motif_51 (1.000)
fragment_465.6650 5.0 motif_51 (1.000)
fragment_431.2350 5.0 motif_51 (1.000)
fragment_353.5950 5.0 motif_51 (1.000)