LDB_256_Argopsin -- LDB_256_Argopsin

Return to experiment 200421_LDB_POS_04
Resolver: mzspec:MS2LDA:TASK-1281:accession:1706360

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_32 0.679 0.163 11 spectra, 5 molecules, 1 class: 100.0% Depsidones
motif_79 0.168 0.795 49 spectra, 32 molecules, 7 classes: 50.0% Depsidones, 12.5% Quinones, 12.5% Pulvinic Acid Derivatives, 9.4% Dibenzofuranes, 6.2% Acids, 6.2% Cleavage Products of Depsides and Depsidones, 3.1% Chromanes and Chromones
motif_17 0.073 0.335 15 spectra, 12 molecules, 5 classes: 33.3% Terpenoids : Triterpenes, 33.3% Depsidones, 16.7% Quinones, 8.3% Diphenylethers, 8.3% Pulvinic Acid Derivatives

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_185.0350 1000.0 motif_32 (0.992)
  • COc1c(C)c(O)cc(C)c1Cl
loss_50.0350 689.0 motif_17 (0.225)
motif_79 (0.774)
fragment_379.0150 689.0 motif_32 (1.000)
  • COc1c(C)c2OC(=O)c3c(C)c(Cl)cc(C=O)c3Oc2c(C)c1Cl
loss_32.0250 511.0 motif_79 (1.000)
fragment_397.0250 511.0 motif_32 (1.000)
  • COc1c(C)c2c(c(C)c1Cl)Oc1c(C=O)c(O)c(Cl)c(C)c1C(=O)O2
fragment_351.0150 338.0 motif_32 (1.000)
  • Cc1cc(Cl)c(C)c2Oc3c(C=O)cc(Cl)c(C)c3C(=O)Oc12
loss_78.0350 338.0 motif_17 (1.000)
loss_18.0150 315.0 motif_53 (1.000)
  • O
fragment_411.0350 315.0 motif_32 (1.000)
fragment_155.0250 197.0 motif_32 (1.000)
  • Cc1cc(O)c(C)c(Cl)c1
fragment_157.0450 168.0 motif_40 (0.280)
motif_32 (0.720)
  • Cc1cc(O)c(C)c(Cl)c1
loss_96.0050 168.0 motif_32 (1.000)
fragment_333.0550 168.0 motif_40 (0.267)
motif_32 (0.733)
  • Cc1ccc(C)c2Oc3c(C=O)c(O)c(Cl)c(C)c3C(=O)Oc12
fragment_237.0350 119.0 motif_32 (1.000)
  • COc1c(C)cc(OccC=O)c(C)c1Cl
loss_192.0150 119.0 motif_32 (1.000)
fragment_186.0450 115.0 motif_32 (1.000)
fragment_290.9950 111.0 motif_32 (1.000)
loss_138.0550 111.0 motif_32 (1.000)
loss_123.9950 97.0 motif_79 (0.979)
motif_32 (0.020)
fragment_305.0550 97.0 motif_40 (0.567)
motif_32 (0.433)
  • Cc1cc(Cl)c(C)c2Oc3cc(O)cc(C)c3C(=O)Oc12
fragment_91.0550 80.0 motif_17 (0.037)
motif_40 (0.043)
motif_53 (0.040)
motif_32 (0.878)
fragment_277.0650 76.0 motif_40 (0.614)
motif_32 (0.385)
loss_151.9850 76.0 motif_32 (1.000)
fragment_212.9950 74.0 motif_40 (0.324)
motif_32 (0.676)
  • Cc1c(cc(C=O)c(O)c1Cl)C(=O)O
fragment_135.0450 69.0 motif_32 (0.999)
  • Cc1ccc(C=O)c(O)c1
fragment_228.9950 60.0 motif_32 (0.999)
fragment_91.9650 55.0 motif_17 (0.014)
motif_40 (0.013)
motif_79 (0.083)
motif_32 (0.890)
fragment_127.0350 50.0 motif_32 (0.999)
  • Cc1ccccc1Cl
fragment_79.0550 44.0 motif_32 (0.997)
fragment_79.2250 35.0 motif_32 (0.999)
fragment_58.0150 33.0 motif_32 (0.999)