Mass2Motif: motif_108

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Mass2Motif Annotation

The following are the full annotation and the short annotation (used for network visualisation) assigned to this Mass2Motif.

Annotation: Hydroxy-staurosporine related Mass2Motif

Short Annotation: Hydroxy-staurosporine related Mass2Motif

Mass2Motif Details

The following table shows the fragment and loss features that are explained by this Mass2Motifs and their corresponding probabilities. After thresholding to save the model, the total probability left in this motif is 0.9692542421486723. The column MAGMa Substructure Annotation shows substructures and the counts of MAGMa annotations for documents linked above threshold to this motif in this experiment. Hovering over each MAGMa substructure shows a plot of the substructure.

Feature Probability MAGMA Substructure Annotation
fragment_311.1500 0.173
loss_188.0500 0.162
fragment_354.1500 0.100
loss_145.0500 0.087
loss_187.0500 0.059
fragment_355.1500 0.035
loss_144.0500 0.033
loss_189.1500 0.028
fragment_312.1500 0.026
fragment_269.1500 0.021
fragment_310.0500 0.015
loss_162.2500 0.014
loss_120.2500 0.014
fragment_350.1500 0.013
fragment_779.3500 0.011
fragment_392.1500 0.011
fragment_268.1500 0.009
fragment_378.1500 0.009
loss_134.2500 0.009
loss_108.1500 0.008
loss_119.1500 0.007
fragment_262.8500 0.005
fragment_393.1500 0.005
fragment_394.1500 0.005
fragment_271.0500 0.004
fragment_117.1500 0.004
loss_192.2500 0.004
fragment_146.0500 0.004
fragment_260.8500 0.004
loss_189.0500 0.004
fragment_188.1500 0.004
loss_30.9500 0.004
fragment_780.3500 0.004
fragment_281.0500 0.003
fragment_352.1500 0.003
fragment_310.1500 0.003
fragment_267.0500 0.003
fragment_190.1500 0.003
fragment_407.1500 0.003
fragment_282.1500 0.003
fragment_421.1500 0.002
loss_159.0500 0.002
fragment_665.3500 0.002
fragment_340.1500 0.002
fragment_129.0500 0.002
fragment_72.0500 0.002
fragment_188.0500 0.002
fragment_814.8500 0.002
fragment_114.0500 0.002
fragment_648.3500 0.002
loss_171.0500 0.002
loss_163.2500 0.002
fragment_349.1500 0.002
loss_147.0500 0.002
fragment_207.2500 0.002
loss_104.4500 0.002
fragment_767.0500 0.002
fragment_384.2500 0.002
fragment_520.7500 0.001
fragment_181.9500 0.001
fragment_557.2500 0.001
loss_55.9500 0.001
fragment_378.2500 0.001
loss_104.9500 0.001
fragment_128.0500 0.001
fragment_781.0500 0.001
fragment_249.0500 0.001
fragment_752.3500 0.001
loss_78.0500 0.001
fragment_413.0500 0.001

Counts of Classyfire Substituent terms

Term name Count in motif Percentage in motif Percentage in experiment Absolute difference
Hydrocarbon derivative 48 100 100 0
Organooxygen compound 48 100 95.3 4.7
Organic nitrogen compound 40 83.3 55.6 27.7
Organonitrogen compound 38 79.2 54.1 25.1
Organopnictogen compound 30 62.5 45.2 17.3
Carbonyl group 29 60.4 44.0 16.4
Azacycle 19 39.6 22.6 17.0
Benzenoid 13 27.1 18.3 8.7
Aromatic heteropolycyclic compound 9 18.8 9.6 9.1
Alcohol 8 16.7 14.7 2.0
Organoheterocyclic compound 8 16.7 13.3 3.3
Secondary alcohol 5 10.4 7.7 2.7
Heteroaromatic compound 5 10.4 5.8 4.7
Carboxamide group 5 10.4 5.5 4.9
Oxacycle 4 8.3 7.9 0.4
Amine 3 6.3 4.4 1.9

Counts of Mass2Motif Features

Two bar plots will appear below this message. The first shows the proportion of the total intensity of these features explained by this Mass2Motif. Red bars show the total intensity (across the whole dataset), blue bars show the proportion explained by the selected Mass2Motif. The second shows the number of times each feature in this Mass2Motif appears in the documents associated with this Mass2Motif.

Fragmentation Spectra Explained by Mass2Motif

The following table lists all fragmentation spectra that are explained by this Mass2Motif at the threshold specified in the experiment option.

Fragmentation spectra Precursor Mass Parent mass Annotation Probability Overlap Score
document_2158 499.2110 499.2110 None 0.944 0.728
document_2066 499.1980 499.1980 None 0.923 0.738
document_2301 512.3420 512.3420 None 0.901 0.259
document_2155 499.2010 499.2010 None 0.895 0.735
document_2156 499.1970 499.1970 None 0.781 0.744
document_2157 499.1970 499.1970 None 0.711 0.646
document_1840 483.2030 483.2030 None 0.564 0.358
document_1841 483.2030 483.2030 None 0.562 0.289
document_5703 871.4490 871.4490 None 0.551 0.243
document_5541 811.3660 811.3660 None 0.520 0.105
document_1839 483.2080 483.2080 None 0.414 0.350
document_2296 511.1690 511.1690 None 0.382 0.252
document_1592 463.3020 463.3020 None 0.286 0.061
document_1803 483.1940 483.1940 7-OH-staurosporine 0.188 0.341
document_1838 483.2010 483.2010 None 0.185 0.308
document_2035 497.1660 497.1660 None 0.182 0.268
document_5806 947.4500 947.4500 None 0.175 0.223
document_5787 931.4500 931.4500 None 0.172 0.244
document_5417 774.6790 774.6790 None 0.170 0.198
document_3378 614.3490 614.3490 None 0.167 0.226
document_245 412.1800 412.1800 None 0.164 0.212
document_5784 931.4360 931.4360 None 0.159 0.253
document_4082 681.2850 681.2850 None 0.152 0.142
document_1802 482.7650 482.7650 7-OH-staurosporine 0.128 0.342
document_5833 965.3950 965.3950 None 0.122 0.355
document_1836 483.2010 483.2010 7-OH-staurosporine 0.120 0.341
document_175 407.0880 407.0880 None 0.114 0.059
document_1157 439.1760 439.1760 None 0.108 0.144
document_1783 478.1370 478.1370 None 0.105 0.065
document_418 417.2240 417.2240 None 0.105 0.164
document_1581 463.3000 463.3000 None 0.105 0.013
document_214 409.3580 409.3580 None 0.101 0.031
document_5862 1020.4960 1020.4960 None 0.100 0.234
document_3862 663.7960 663.7960 None 0.097 0.103
document_2489 529.1960 529.1960 None 0.095 0.208
document_3698 642.3820 642.3820 None 0.093 0.203
document_2530 533.1510 533.1510 None 0.092 0.252
document_4875 725.2820 725.2820 None 0.080 0.355
document_2968 575.2780 575.2780 None 0.076 0.175
document_2768 557.2890 557.2890 None 0.075 0.105
document_1950 490.2730 490.2730 None 0.071 0.180
document_2576 538.2520 538.2520 None 0.069 0.173
document_1955 490.3190 490.3190 None 0.068 0.138
document_1563 463.2780 463.2780 None 0.064 0.089
document_2041 497.2180 497.2180 None 0.063 0.273
document_3132 591.2460 591.2460 None 0.060 0.193
document_4614 711.4990 711.4990 None 0.059 0.173
document_2060 497.3590 497.3590 None 0.051 0.177

Fragmentation Spectra Plot

The fragmentation spectra of molecules explained by this Mass2Motif are plotted below. Features (fragments and losses) explained by this Mass2Motif will be coloured red, while parent ion is coloured in blue. Click Next and Previous to cycle through the fragmentation spectra.