Mass2Motif: motif_244

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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: None

Short Annotation: None

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 0.9912481811281476. 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_81.0500 0.976
fragment_315.2500 0.013
fragment_62.0500 0.002

Counts of Classyfire Substituent terms

Term name Count in motif Percentage in motif Percentage in experiment Absolute difference
Hydrocarbon derivative 253 100 100 0
Organooxygen compound 229 90.5 95.3 4.8
Carbonyl group 104 41.1 44.0 2.9
Aliphatic acyclic compound 61 24.1 2.9 21.2
Organic nitrogen compound 53 20.9 55.6 34.7
Alcohol 49 19.4 14.7 4.7
Organonitrogen compound 46 18.2 54.1 35.9
Organopnictogen compound 31 12.3 45.2 33.0
Secondary alcohol 19 7.5 7.7 0.2
Azacycle 13 5.1 22.6 17.5
Aromatic heteropolycyclic compound 7 2.8 9.6 6.9
Benzenoid 6 2.4 18.3 16.0
Organoheterocyclic compound 5 2.0 13.3 11.3
Heteroaromatic compound 4 1.6 5.8 4.2
Primary alcohol 4 1.6 0.9 0.7
Oxacycle 4 1.6 7.9 6.3
Acetal 4 1.6 1.5 0.1
Oxane 3 1.2 1.9 0.7
O-glycosyl compound 3 1.2 1.2 0.0
Polyol 3 1.2 1.6 0.4
Glycosyl compound 2 0.8 0.7 0.0
Amine 1 0.4 4.4 4.0
1-hydroxy-2-unsubstituted benzenoid 1 0.4 1.3 0.9
Aliphatic homopolycyclic compound 1 0.4 0.0 0.4

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_1445 456.2700 456.2700 None 0.355 0.013
document_206 408.3070 408.3070 None 0.294 0.976
document_1446 456.2700 456.2700 None 0.279 0.015
document_4304 692.4670 692.4670 None 0.278 0.976
document_4836 720.5530 720.5530 None 0.252 0.976
document_5117 740.4640 740.4640 None 0.246 0.978
document_4217 690.4010 690.4010 None 0.225 0.976
document_4264 690.4020 690.4020 None 0.221 0.976
document_2569 537.4880 537.4880 None 0.213 0.972
document_5161 740.5190 740.5190 None 0.211 0.976
document_480 419.2760 419.2760 None 0.205 0.976
document_1394 452.4250 452.4250 None 0.199 0.975
document_4252 690.4450 690.4450 None 0.197 0.976
document_4279 690.5070 690.5070 None 0.194 0.976
document_5196 744.4430 744.4430 None 0.190 0.976
document_4670 716.8370 716.8370 None 0.190 0.973
document_75 401.2590 401.2590 Massbank:FFF00078 Stigmastanol 0.188 0.976
document_4280 690.5070 690.5070 None 0.187 0.976
document_3290 608.2930 608.2930 None 0.183 0.967
document_4770 718.4290 718.4290 None 0.182 0.976
document_1522 460.3010 460.3010 None 0.176 0.976
document_494 419.2770 419.2770 None 0.173 0.976
document_5210 744.4800 744.4800 None 0.172 0.976
document_4825 718.5380 718.5380 None 0.172 0.976
document_2573 537.4880 537.4880 None 0.168 0.976
document_4164 688.3860 688.3860 None 0.168 0.976
document_2571 537.4870 537.4870 None 0.165 0.973
document_3009 579.5350 579.5350 None 0.163 0.972
document_4505 704.4150 704.4150 None 0.162 0.976
document_3975 676.4660 676.4660 None 0.162 0.976
document_4784 718.4920 718.4920 None 0.161 0.976
document_3015 580.4190 580.4190 None 0.161 0.976
document_4698 716.4150 716.4150 None 0.159 0.976
document_4759 718.4300 718.4300 None 0.158 0.976
document_4326 692.5210 692.5210 None 0.157 0.976
document_1913 487.3580 487.3580 None 0.155 0.976
document_221 409.3820 409.3820 None 0.155 0.965
document_2681 551.3710 551.3710 None 0.154 0.976
document_4701 716.4430 716.4430 None 0.154 0.972
document_4673 716.4480 716.4480 None 0.153 0.970
document_4177 689.1730 689.1730 None 0.152 0.976
document_4218 690.4010 690.4010 None 0.152 0.976
document_4839 720.5540 720.5540 None 0.151 0.976
document_234 411.2430 411.2430 None 0.150 0.976
document_89 401.2860 401.2860 Massbank:FFF00098 24-Ethylcoprostanol 0.149 0.976
document_4729 716.4160 716.4160 None 0.148 0.975
document_204 408.3070 408.3070 None 0.142 0.976
document_4188 689.8790 689.8790 None 0.140 0.976
document_2568 537.4880 537.4880 None 0.140 0.976
document_2713 551.5040 551.5040 None 0.140 0.976
document_1461 458.9730 458.9730 None 0.140 0.976
document_4824 718.5370 718.5370 None 0.139 0.976
document_4719 716.4150 716.4150 None 0.138 0.976
document_4084 681.5010 681.5010 None 0.135 0.976
document_4184 689.6260 689.6260 None 0.134 0.976
document_4219 690.4500 690.4500 None 0.134 0.976
document_4712 716.4150 716.4150 None 0.133 0.976
document_5134 740.4760 740.4760 None 0.132 0.974
document_4694 716.4510 716.4510 None 0.130 0.976
document_4704 716.4750 716.4750 None 0.128 0.968
document_4249 690.4640 690.4640 None 0.127 0.976
document_4211 690.4010 690.4010 None 0.126 0.976
document_4266 690.4520 690.4520 None 0.126 0.976
document_4786 718.4770 718.4770 None 0.125 0.976
document_4665 716.4150 716.4150 None 0.123 0.976
document_3873 664.3880 664.3880 None 0.121 0.976
document_4187 690.0880 690.0880 None 0.121 0.976
document_4720 716.4150 716.4150 None 0.121 0.976
document_3859 663.4620 663.4620 None 0.120 0.976
document_4281 690.5070 690.5070 None 0.120 0.976
document_4521 704.4280 704.4280 None 0.120 0.976
document_4706 716.4150 716.4150 None 0.117 0.976
document_149 404.2400 404.2400 None 0.115 0.974
document_4525 704.4150 704.4150 None 0.114 0.976
document_4710 716.4570 716.4570 None 0.114 0.976
document_4779 718.4300 718.4300 None 0.113 0.976
document_4205 690.4010 690.4010 None 0.112 0.976
document_5088 738.4170 738.4170 None 0.112 0.976
document_5184 744.4430 744.4430 None 0.112 0.976
document_159 405.2930 405.2930 None 0.112 0.974
document_3968 675.6760 675.6760 None 0.111 0.976
document_5162 740.5190 740.5190 None 0.110 0.973
document_4513 704.4150 704.4150 None 0.109 0.976
document_5014 734.4260 734.4260 None 0.109 0.975
document_4734 716.4700 716.4700 None 0.109 0.976
document_4965 732.4050 732.4050 None 0.108 0.975
document_4272 690.5050 690.5050 None 0.108 0.969
document_4618 712.3820 712.3820 None 0.107 0.976
document_4248 690.4020 690.4020 None 0.106 0.976
document_4771 718.4300 718.4300 None 0.106 0.976
document_4278 690.5070 690.5070 None 0.105 0.972
document_5205 744.4430 744.4430 None 0.104 0.976
document_4522 704.4150 704.4150 None 0.103 0.976
document_4718 716.4150 716.4150 None 0.103 0.976
document_4702 716.4150 716.4150 None 0.101 0.976
document_4773 718.4300 718.4300 None 0.099 0.976
document_4170 690.0860 690.0860 None 0.099 0.976
document_5114 740.4490 740.4490 None 0.098 0.972
document_3498 629.9460 629.9460 None 0.098 0.975
document_4526 704.4150 704.4150 None 0.098 0.976
document_5164 740.5190 740.5190 None 0.097 0.974
document_4250 690.4750 690.4750 None 0.097 0.976
document_1393 452.4240 452.4240 None 0.097 0.976
document_5075 738.3950 738.3950 None 0.096 0.976
document_689 425.1270 425.1270 None 0.096 0.976
document_3942 673.3250 673.3250 None 0.095 0.976
document_3118 590.4190 590.4190 None 0.095 0.975
document_4257 690.4330 690.4330 None 0.095 0.976
document_4764 718.4290 718.4290 None 0.095 0.974
document_4686 716.4150 716.4150 None 0.094 0.976
document_4520 704.4700 704.4700 None 0.094 0.971
document_4725 716.4400 716.4400 None 0.094 0.976
document_4233 690.4080 690.4080 None 0.094 0.976
document_3964 676.2690 676.2690 None 0.094 0.969
document_4224 690.4010 690.4010 None 0.093 0.975
document_4203 690.4560 690.4560 None 0.093 0.975
document_4251 690.4020 690.4020 None 0.093 0.976
document_4216 690.4010 690.4010 None 0.092 0.976
document_4228 690.4010 690.4010 None 0.092 0.975
document_4162 688.4700 688.4700 None 0.092 0.976
document_4835 720.6570 720.6570 None 0.091 0.971
document_4689 716.4150 716.4150 None 0.091 0.976
document_4696 716.4150 716.4150 None 0.090 0.976
document_4524 704.4150 704.4150 None 0.090 0.976
document_4516 704.4150 704.4150 None 0.089 0.976
document_4245 690.4020 690.4020 None 0.089 0.976
document_4676 716.4310 716.4310 None 0.089 0.976
document_5129 740.4900 740.4900 None 0.088 0.974
document_4510 704.4150 704.4150 None 0.087 0.976
document_2188 502.2550 502.2550 None 0.087 0.975
document_4223 690.4170 690.4170 None 0.087 0.976
document_4684 716.4140 716.4140 None 0.086 0.976
document_5070 738.3950 738.3950 None 0.086 0.976
document_4238 690.4440 690.4440 None 0.086 0.976
document_1822 481.4000 481.4000 None 0.086 0.974
document_4236 690.4010 690.4010 None 0.086 0.976
document_4242 690.4290 690.4290 None 0.085 0.976
document_5054 738.4300 738.4300 None 0.085 0.976
document_4276 690.5060 690.5060 None 0.085 0.976
document_4176 690.1880 690.1880 None 0.085 0.976
document_846 430.0400 430.0400 None 0.084 0.976
document_4169 690.2770 690.2770 None 0.084 0.976
document_4234 690.4020 690.4020 None 0.083 0.976
document_3397 616.4320 616.4320 None 0.083 0.974
document_4267 690.4560 690.4560 None 0.083 0.976
document_2249 506.5280 506.5280 None 0.083 0.976
document_2618 542.8870 542.8870 None 0.082 0.976
document_4733 716.4340 716.4340 None 0.082 0.976
document_469 419.2660 419.2660 None 0.082 0.976
document_4320 692.5180 692.5180 None 0.082 0.971
document_2252 506.5280 506.5280 None 0.082 0.971
document_4826 718.5370 718.5370 None 0.082 0.976
document_5032 738.1580 738.1580 None 0.082 0.976
document_2574 537.4880 537.4880 None 0.081 0.976
document_3973 676.4120 676.4120 None 0.081 0.976
document_4209 690.4010 690.4010 None 0.081 0.970
document_2827 564.2840 564.2840 None 0.081 0.976
document_4687 716.4150 716.4150 None 0.081 0.976
document_4229 690.4010 690.4010 None 0.080 0.976
document_3148 593.4490 593.4490 None 0.080 0.968
document_4235 690.4480 690.4480 None 0.079 0.976
document_4275 690.5060 690.5060 None 0.079 0.969
document_4215 690.4010 690.4010 None 0.078 0.976
document_5195 744.4430 744.4430 None 0.078 0.976
document_4527 704.4150 704.4150 None 0.077 0.976
document_4675 716.4260 716.4260 None 0.077 0.976
document_4708 716.4150 716.4150 None 0.076 0.974
document_4246 690.4320 690.4320 None 0.076 0.976
document_5199 744.4430 744.4430 None 0.076 0.976
document_3872 664.3880 664.3880 None 0.075 0.976
document_4261 690.4420 690.4420 None 0.075 0.976
document_4693 716.4150 716.4150 None 0.075 0.976
document_4227 690.4010 690.4010 None 0.075 0.976
document_4678 716.4250 716.4250 None 0.075 0.976
document_4232 690.4010 690.4010 None 0.075 0.976
document_4247 690.4260 690.4260 None 0.074 0.976
document_5083 738.4390 738.4390 None 0.074 0.976
document_3715 644.4630 644.4630 None 0.074 0.976
document_4243 690.4440 690.4440 None 0.074 0.976
document_3741 646.2990 646.2990 None 0.074 0.965
document_4183 690.1000 690.1000 None 0.074 0.976
document_4772 718.4300 718.4300 None 0.073 0.976
document_5189 744.4430 744.4430 None 0.073 0.976
document_4707 716.4150 716.4150 None 0.073 0.976
document_5573 819.5000 819.5000 None 0.072 0.973
document_5190 744.4430 744.4430 None 0.072 0.976
document_4255 690.4020 690.4020 None 0.072 0.976
document_4774 718.4300 718.4300 None 0.071 0.976
document_4819 718.5340 718.5340 None 0.070 0.976
document_5181 744.4430 744.4430 None 0.070 0.975
document_4206 690.4020 690.4020 None 0.070 0.976
document_4226 690.4350 690.4350 None 0.069 0.976
document_4769 718.4710 718.4710 None 0.069 0.976
document_4173 689.9500 689.9500 None 0.069 0.976
document_3533 634.3370 634.3370 None 0.068 0.975
document_4735 716.4160 716.4160 None 0.068 0.974
document_1625 467.1000 467.1000 None 0.068 0.976
document_1870 485.2900 485.2900 None 0.067 0.970
document_4392 702.4100 702.4100 None 0.067 0.975
document_4622 712.4170 712.4170 None 0.067 0.976
document_4677 716.4320 716.4320 None 0.067 0.969
document_4506 704.4150 704.4150 None 0.067 0.976
document_4780 718.4290 718.4290 None 0.066 0.976
document_4595 710.4200 710.4200 None 0.066 0.972
document_4263 690.4020 690.4020 None 0.066 0.976
document_4608 710.4730 710.4730 None 0.066 0.974
document_4628 712.4880 712.4880 None 0.066 0.974
document_2315 511.7520 511.7520 None 0.065 0.976
document_4697 716.4150 716.4150 None 0.065 0.976
document_4667 716.4150 716.4150 None 0.065 0.976
document_4822 718.5340 718.5340 None 0.065 0.976
document_5044 738.3950 738.3950 None 0.064 0.976
document_4606 710.4740 710.4740 None 0.064 0.975
document_2727 555.1430 555.1430 None 0.064 0.976
document_4515 704.4150 704.4150 None 0.063 0.975
document_4716 716.4150 716.4150 None 0.063 0.976
document_4262 690.4600 690.4600 None 0.063 0.976
document_4508 704.4150 704.4150 None 0.063 0.976
document_5140 740.5140 740.5140 None 0.063 0.973
document_4268 690.4490 690.4490 None 0.062 0.976
document_5185 744.4430 744.4430 None 0.062 0.976
document_3858 664.3400 664.3400 None 0.061 0.976
document_4682 716.4150 716.4150 None 0.061 0.976
document_5051 738.3980 738.3980 None 0.060 0.976
document_4511 704.4740 704.4740 None 0.060 0.976
document_4182 690.0640 690.0640 None 0.059 0.976
document_4680 716.4150 716.4150 None 0.059 0.976
document_4723 716.4160 716.4160 None 0.059 0.976
document_3850 663.2920 663.2920 None 0.059 0.976
document_4685 716.4150 716.4150 None 0.058 0.976
document_5107 740.4220 740.4220 None 0.058 0.976
document_3547 636.4050 636.4050 None 0.057 0.976
document_4721 716.4150 716.4150 None 0.057 0.976
document_4244 690.4230 690.4230 None 0.056 0.976
document_5182 744.4480 744.4480 None 0.055 0.976
document_3537 634.3070 634.3070 None 0.055 0.976
document_232 411.1490 411.1490 None 0.055 0.976
document_753 428.4460 428.4460 None 0.055 0.976
document_5050 738.4060 738.4060 None 0.054 0.976
document_4220 690.4010 690.4010 None 0.054 0.976
document_4369 698.4390 698.4390 None 0.054 0.976
document_4668 716.4140 716.4140 None 0.053 0.972
document_374 413.3770 413.3770 None 0.053 0.976
document_5126 740.4340 740.4340 None 0.053 0.978
document_5183 744.4440 744.4440 None 0.053 0.976
document_4602 710.4560 710.4560 None 0.052 0.975
document_4556 706.3940 706.3940 None 0.052 0.974
document_4598 710.4380 710.4380 None 0.052 0.971
document_4307 692.5170 692.5170 None 0.051 0.976
document_2792 560.4800 560.4800 None 0.051 0.975
document_5079 738.3950 738.3950 None 0.051 0.976
document_5572 819.4800 819.4800 None 0.050 0.976
document_4841 721.8480 721.8480 None 0.050 0.976

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.