LDB_814_Psoromic acid -- LDB_814_Psoromic acid

Return to experiment 200421_LDB_NEG_07
Resolver: mzspec:MS2LDA:TASK-1282:accession:1707094

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_80 0.913 0.432 16 spectra, 9 molecules, 3 classes: 55.6% Quinones, 22.2% Dibenzofuranes, 22.2% Depsidones
motif_15 0.087 0.547 41 spectra, 27 molecules, 8 classes: 48.1% Depsidones, 25.9% Paraconic acids, 7.4% Acids, 3.7% Pulvinic Acid Derivatives, 3.7% Cleavage Products of Depsides and Depsidones, 3.7% Depsides (Tridepsides), 3.7% Diphenylethers, 3.7% Xanthones and bis-Xanthones

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
loss_180.0250 1000.0 motif_80 (1.000)
fragment_209.0550 1000.0 motif_80 (1.000)
fragment_254.0650 883.0 motif_80 (1.000)
loss_135.0150 883.0 motif_80 (1.000)
loss_76.0150 671.0 motif_15 (1.000)
fragment_313.0650 671.0 motif_80 (1.000)
fragment_253.0450 535.0 motif_80 (1.000)
loss_136.0350 535.0 motif_15 (0.016)
motif_80 (0.984)
loss_164.0250 489.0 motif_80 (1.000)
fragment_225.0550 489.0 motif_80 (1.000)
loss_152.0150 483.0 motif_80 (1.000)
fragment_237.0550 483.0 motif_80 (1.000)
fragment_226.0550 362.0 motif_80 (1.000)
loss_163.0250 362.0 motif_80 (1.000)
loss_108.0350 334.0 motif_80 (1.000)
fragment_281.0450 334.0 motif_80 (1.000)
loss_32.0250 282.0 motif_15 (1.000)
fragment_357.0550 282.0 motif_80 (1.000)
fragment_181.0650 264.0 motif_80 (1.000)
loss_75.0150 148.0 motif_80 (1.000)
fragment_314.0650 148.0 motif_80 (1.000)
fragment_149.0550 143.0 motif_80 (1.000)
fragment_105.0350 110.0 motif_80 (1.000)
  • Cc1cccc(O)c1
loss_31.0250 79.0 motif_80 (1.000)
fragment_358.0550 79.0 motif_80 (1.000)
fragment_122.0350 27.0 motif_80 (1.000)
fragment_621.4450 11.0 motif_80 (0.999)
fragment_657.6750 11.0 motif_80 (0.999)