document_3114 -- document_3114

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Resolver: mzspec:MS2LDA:TASK-551:accession:628012

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_291 0.467 0.236 None
motif_123 0.384 0.714 None
motif_99 0.053 0.647 Salinispora arenicola related substructure [109, 95, 55]

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.

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_155.0500 1000.0 motif_123 (1.000)
fragment_435.3500 1000.0 motif_291 (1.000)
loss_154.0500 625.0 motif_123 (1.000)
fragment_436.3500 625.0 motif_291 (1.000)
fragment_343.3500 432.0 motif_291 (1.000)
fragment_58.0500 296.0 motif_123 (1.000)
fragment_109.0500 282.0 motif_123 (0.019)
motif_99 (0.979)
fragment_344.3500 160.0 motif_291 (1.000)
fragment_81.0500 159.0 motif_244 (1.000)
fragment_97.1500 136.0 motif_153 (0.958)
motif_32 (0.041)
fragment_69.0500 89.0 motif_99 (0.011)
motif_271 (0.989)
fragment_345.3500 83.0 motif_291 (0.921)
motif_123 (0.079)
fragment_156.0500 64.0 motif_123 (0.999)
loss_140.0500 24.0 motif_32 (0.999)
fragment_450.4500 24.0 motif_32 (0.994)
loss_109.3500 23.0 motif_291 (0.993)
fragment_481.0500 23.0 motif_291 (0.993)
fragment_166.0500 19.0 motif_290 (0.999)
fragment_207.1500 17.0 motif_289 (0.999)
fragment_189.1500 16.0 motif_291 (0.772)
motif_153 (0.204)
motif_123 (0.024)
fragment_331.1500 14.0 motif_291 (0.995)
loss_197.4500 14.0 motif_291 (0.989)
fragment_392.9500 14.0 motif_291 (0.989)
fragment_361.3500 13.0 motif_291 (0.991)
fragment_451.4500 13.0 motif_32 (0.992)
loss_139.0500 13.0 motif_32 (1.000)
fragment_295.1500 11.0 motif_291 (0.997)
fragment_260.9500 10.0 motif_291 (0.979)
motif_123 (0.019)