M/Z: 799.5795
Hit 2 annotations: (2r)-2-[(2r)-2-[(2r)-2-[(2r)-2-{[(2r)-2-[(2s)-n,4-dimethyl-2-(methylamino)pentanamido]-1-hydroxy-3-methylbutylidene]amino}-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-3-methyl-n-(2-phenylethyl)butanimidic acid_[M]+
; PA(22:0/20:3(6,8,11)-OH(5))_[M+H]+
- Confirmed: 这个参考离子已经通过手动审计得到确认和验证。
- Reliable: 这个参考离子可能在特定的解剖组织环境中高度保守。
- Unreliable: 这个参考离子具有较高的排名价值,但缺乏可重复性。
- Unavailable: 由于排名价值低且缺乏可重复性,这个参考离子不应用于注释。
Found 10 Reference Ions Near m/z 799.5795
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000043754 Unreliable | 799.5712 | 799.5712 ~ 799.5712 MzDiff: none |
PA(22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000190644) Formula: C45H83O9P (798.5774) |
1.32 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000009114 Unreliable | 799.5796 | 799.5796 ~ 799.5796 MzDiff: none |
(2r)-2-[(2r)-2-[(2r)-2-[(2r)-2-{[(2r)-2-[(2s)-n,4-dimethyl-2-(methylamino)pentanamido]-1-hydroxy-3-methylbutylidene]amino}-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-3-methyl-n-(2-phenylethyl)butanimidic acid (BioDeep_00002274159) Formula: C44H77N7O6 (799.5935) |
3.07 (100%) | Mus musculus [UBERON:0004645] urinary bladder urothelium |
MSI_000009152 Unreliable | 799.5713 | 799.5713 ~ 799.5713 MzDiff: none |
PA(22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000190644) Formula: C45H83O9P (798.5774) |
3.03 (100%) | Mus musculus [UBERON:0004645] urinary bladder urothelium |
MSI_000000591 Unavailable | 799.5713 | 799.5713 ~ 799.5713 MzDiff: none |
PA(22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000190644) Formula: C45H83O9P (798.5774) |
-0.48 (100%) | Mus musculus [CL:0000066] epithelial cell |
MSI_000000797 Unavailable | 799.5796 | 799.5796 ~ 799.5796 MzDiff: none |
(2r)-2-[(2r)-2-[(2r)-2-[(2r)-2-{[(2r)-2-[(2s)-n,4-dimethyl-2-(methylamino)pentanamido]-1-hydroxy-3-methylbutylidene]amino}-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-3-methyl-n-(2-phenylethyl)butanimidic acid (BioDeep_00002274159) Formula: C44H77N7O6 (799.5935) |
-0.6 (100%) | Mus musculus [CL:0000066] epithelial cell |
MSI_000028232 Unreliable | 799.5848 | 799.5848 ~ 799.5848 MzDiff: none |
PC(18:2/18:2) (BioDeep_00000019232) Formula: C44H80NO8P (781.5621) |
1.64 (100%) | Macropus giganteus [UBERON:0001891] midbrain |
MSI_000028486 Unreliable | 799.5739 | 799.5739 ~ 799.5739 MzDiff: none |
PA(22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000190644) Formula: C45H83O9P (798.5774) |
1.02 (100%) | Macropus giganteus [UBERON:0001891] midbrain |
MSI_000029472 Unreliable | 799.5739 | 799.5739 ~ 799.5739 MzDiff: none |
PA(22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000190644) Formula: C45H83O9P (798.5774) |
0.78 (100%) | Macropus giganteus [UBERON:0002336] corpus callosum |
MSI_000030947 Unreliable | 799.5739 | 799.5739 ~ 799.5739 MzDiff: none |
PA(22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000190644) Formula: C45H83O9P (798.5774) |
0.5 (100%) | Macropus giganteus [UBERON:0003027] cingulate cortex |
MSI_000044121 Unreliable | 799.5706 | 799.5706 ~ 799.5706 MzDiff: none |
PA(22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000190644) Formula: C45H83O9P (798.5774) |
1.32 (100%) | Rattus norvegicus [UBERON:0002264] olfactory bulb |
Found 4 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
(2r)-2-[(2r)-2-[(2r)-2-[(2r)-2-{[(2r)-2-[(2s)-n,4-dimethyl-2-(methylamino)pentanamido]-1-hydroxy-3-methylbutylidene]amino}-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-n,3-dimethylbutanamido]-3-methyl-n-(2-phenylethyl)butanimidic acid Formula: C44H77N7O6 (799.5935) Adducts: [M]+ (Ppm: 16.7) |
Mus musculus (Urinary bladder) |
HR2MSI_mouse_urinary_bladder - S096Resolution: 10μm, 260x134
Mass spectrometry imaging of phospholipids in mouse urinary bladder (imzML dataset) |
|
PA(22:0/20:3(6,8,11)-OH(5)) Formula: C45H83O9P (798.5774) Adducts: [M+H]+ (Ppm: 6.5) |
Mus musculus (Lung) |
image5Resolution: 40μm, 163x183
Supplementary Figure S8. MALDI-MSI data of mouse lung tissue administered with D9-choline and
U 13C-DPPC–containing Poractant alfa surfactant (labels administered 18 h prior to sacrifice). Ion
images of (a) m/z 796.6856 ([U13C-DPPC+Na]+), (b) m/z 756.5154 [PC32:0+Na]+ and (c) m/z 765.6079
([D9-PC32:0+Na]+). (d) Overlay image of [U13C-DPPC+Na]+ (red) and [D9-PC32:0+Na]+ (green).
Parts per million (ppm) mass errors are indicated in parentheses. All images were visualised using totalion-current normalisation and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0. |
|
PA(22:0/20:3(6,8,11)-OH(5)) Formula: C45H83O9P (798.5774) Adducts: [M+H]+ (Ppm: 13.5) |
Macropus giganteus (Brain) |
170321_kangaroobrain-dan3-pos_maxof50.0_med1Resolution: 50μm, 81x50
Sample information
Organism: Macropus giganteus (kangaroo)
Organism part: Brain
Condition: Wildtype
Sample growth conditions: Wild |
|
PA(22:0/20:3(6,8,11)-OH(5)) Formula: C45H83O9P (798.5774) Adducts: [M+H]+ (Ppm: 6) |
Mus musculus (Liver) |
Salmonella_final_pos_recalResolution: 17μm, 691x430
A more complete and holistic view on host–microbe interactions is needed to understand the physiological and cellular barriers that affect the efficacy of drug treatments and allow the discovery and development of new therapeutics. Here, we developed a multimodal imaging approach combining histopathology with mass spectrometry imaging (MSI) and same section imaging mass cytometry (IMC) to study the effects of Salmonella Typhimurium infection in the liver of a mouse model using the S. Typhimurium strains SL3261 and SL1344. This approach enables correlation of tissue morphology and specific cell phenotypes with molecular images of tissue metabolism. IMC revealed a marked increase in immune cell markers and localization in immune aggregates in infected tissues. A correlative computational method (network analysis) was deployed to find metabolic features associated with infection and revealed metabolic clusters of acetyl carnitines, as well as phosphatidylcholine and phosphatidylethanolamine plasmalogen species, which could be associated with pro-inflammatory immune cell types. By developing an IMC marker for the detection of Salmonella LPS, we were further able to identify and characterize those cell types which contained S. Typhimurium.
[dataset] Nicole Strittmatter. Holistic Characterization of a Salmonella Typhimurium Infection Model Using Integrated Molecular Imaging, metabolights_dataset, V1; 2022. https://www.ebi.ac.uk/metabolights/MTBLS2671. |
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