- 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 27 Reference Ions Near m/z 864.682
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000046774 Reliable | 864.6866 | 864.6866 ~ 864.6866 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
3.46 (100%) | Mus musculus [UBERON:0002107] liver |
MSI_000007258 Unreliable | 864.6883 | 864.6881 ~ 864.6884 MzDiff: 1.5 ppm |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
4.6 (100%) | Rattus norvegicus [UBERON:0004359] corpus epididymis |
MSI_000063449 Unreliable | 864.6884 | 864.6884 ~ 864.6884 MzDiff: 0.0 ppm |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
2.87 (100%) | Mus musculus [UBERON:0002421] hippocampal formation |
MSI_000001186 Unavailable | 864.682 | 864.682 ~ 864.682 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.46 (100%) | Mus musculus [UBERON:0001224] renal pelvis |
MSI_000001779 Unavailable | 864.682 | 864.682 ~ 864.682 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.59 (100%) | Mus musculus [UBERON:0001225] cortex of kidney |
MSI_000002284 Unavailable | 864.682 | 864.682 ~ 864.682 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.62 (100%) | Mus musculus [UBERON:0001293] outer medulla of kidney |
MSI_000002765 Unavailable | 864.6847 | 864.6847 ~ 864.6847 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.42 (100%) | Rattus norvegicus [UBERON:0001950] neocortex |
MSI_000002938 Unavailable | 864.6909 | 864.6909 ~ 864.6909 MzDiff: none |
(2r)-2-hydroxy-n-[(2s,3r,4e,8e,10e)-3-hydroxy-9-methyl-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadeca-4,8,10-trien-2-yl]hexacos-17-enimidic acid (BioDeep_00002216425) Formula: C51H93NO9 (863.685) |
-0.63 (100%) | Rattus norvegicus [UBERON:0001950] neocortex |
MSI_000002980 Unavailable | 864.6761 | 864.6761 ~ 864.6761 MzDiff: none |
n-(3,4-dihydroxy-1-{[hydroxy((2,3,4,5,6-pentahydroxycyclohexyl)oxy)phosphoryl]oxy}octadecan-2-yl)octadecanimidic acid (BioDeep_00002093171) Formula: C42H84NO12P (825.5731) |
-0.75 (100%) | Rattus norvegicus [UBERON:0001950] neocortex |
MSI_000003605 Unavailable | 864.6847 | 864.6847 ~ 864.6847 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.71 (100%) | Rattus norvegicus [UBERON:0002037] cerebellum |
MSI_000003639 Unavailable | 864.6909 | 864.6909 ~ 864.6909 MzDiff: none |
(2r)-2-hydroxy-n-[(2s,3r,4e,8e,10e)-3-hydroxy-9-methyl-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadeca-4,8,10-trien-2-yl]hexacos-17-enimidic acid (BioDeep_00002216425) Formula: C51H93NO9 (863.685) |
-0.79 (100%) | Rattus norvegicus [UBERON:0002037] cerebellum |
MSI_000003679 Unavailable | 864.6761 | 864.6761 ~ 864.6761 MzDiff: none |
n-(3,4-dihydroxy-1-{[hydroxy((2,3,4,5,6-pentahydroxycyclohexyl)oxy)phosphoryl]oxy}octadecan-2-yl)octadecanimidic acid (BioDeep_00002093171) Formula: C42H84NO12P (825.5731) |
-1.04 (100%) | Rattus norvegicus [UBERON:0002037] cerebellum |
MSI_000004753 Unreliable | 864.6847 | 864.6847 ~ 864.6847 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
2.25 (100%) | Rattus norvegicus [UBERON:0002298] brainstem |
MSI_000004767 Unreliable | 864.6909 | 864.6909 ~ 864.6909 MzDiff: none |
(2r)-2-hydroxy-n-[(2s,3r,4e,8e,10e)-3-hydroxy-9-methyl-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadeca-4,8,10-trien-2-yl]hexacos-17-enimidic acid (BioDeep_00002216425) Formula: C51H93NO9 (863.685) |
2.17 (100%) | Rattus norvegicus [UBERON:0002298] brainstem |
MSI_000004787 Unreliable | 864.6761 | 864.6761 ~ 864.6761 MzDiff: none |
n-(3,4-dihydroxy-1-{[hydroxy((2,3,4,5,6-pentahydroxycyclohexyl)oxy)phosphoryl]oxy}octadecan-2-yl)octadecanimidic acid (BioDeep_00002093171) Formula: C42H84NO12P (825.5731) |
2.02 (100%) | Rattus norvegicus [UBERON:0002298] brainstem |
MSI_000005599 Unreliable | 864.6761 | 864.6761 ~ 864.6761 MzDiff: none |
n-(3,4-dihydroxy-1-{[hydroxy((2,3,4,5,6-pentahydroxycyclohexyl)oxy)phosphoryl]oxy}octadecan-2-yl)octadecanimidic acid (BioDeep_00002093171) Formula: C42H84NO12P (825.5731) |
0.08 (100%) | Rattus norvegicus [UBERON:0002435] striatum |
MSI_000005626 Unavailable | 864.6909 | 864.6909 ~ 864.6909 MzDiff: none |
(2r)-2-hydroxy-n-[(2s,3r,4e,8e,10e)-3-hydroxy-9-methyl-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadeca-4,8,10-trien-2-yl]hexacos-17-enimidic acid (BioDeep_00002216425) Formula: C51H93NO9 (863.685) |
-0.24 (100%) | Rattus norvegicus [UBERON:0002435] striatum |
MSI_000005699 Unavailable | 864.6847 | 864.6847 ~ 864.6847 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.49 (100%) | Rattus norvegicus [UBERON:0002435] striatum |
MSI_000026434 Unreliable | 864.6866 | 864.6866 ~ 864.6866 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
1.79 (100%) | Mus musculus [UBERON:0002048] lung |
MSI_000026577 Unreliable | 864.6813 | 864.6813 ~ 864.6813 MzDiff: none |
Not Annotated | 1.79 (0%) | Mus musculus [UBERON:0002048] lung |
MSI_000026739 Unreliable | 864.6919 | 864.6919 ~ 864.6919 MzDiff: none |
TG(14:0/20:4(5Z,8Z,11Z,14Z)/18:4(6Z,9Z,12Z,15Z)) (BioDeep_00000037166) Formula: C55H90O6 (846.6737) |
1.79 (100%) | Mus musculus [UBERON:0002048] lung |
MSI_000028374 Unreliable | 864.6907 | 864.6907 ~ 864.6907 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
1.27 (100%) | Macropus giganteus [UBERON:0001891] midbrain |
MSI_000028450 Unreliable | 864.6828 | 864.6828 ~ 864.6828 MzDiff: none |
Not Annotated | 1.1 (0%) | Macropus giganteus [UBERON:0001891] midbrain |
MSI_000029561 Unreliable | 864.6828 | 864.6828 ~ 864.6828 MzDiff: none |
Not Annotated | 0.38 (0%) | Macropus giganteus [UBERON:0002336] corpus callosum |
MSI_000029666 Unavailable | 864.6907 | 864.6907 ~ 864.6907 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.05 (100%) | Macropus giganteus [UBERON:0002336] corpus callosum |
MSI_000030788 Unreliable | 864.6907 | 864.6907 ~ 864.6907 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
0.99 (100%) | Macropus giganteus [UBERON:0003027] cingulate cortex |
MSI_000044414 Unavailable | 864.6882 | 864.6882 ~ 864.6882 MzDiff: none |
PE(22:2(13Z,16Z)/24:1(15Z)) (BioDeep_00000030781) Formula: C51H96NO8P (881.6873) |
-0.17 (100%) | Rattus norvegicus [UBERON:0002264] olfactory bulb |
Found 7 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
PE(22:2(13Z,16Z)/24:1(15Z)) Formula: C51H96NO8P (881.6873) Adducts: [M+H-H2O]+ (Ppm: 2.3) |
Mus musculus (Kidney) |
FULL_MS_centriod_CHCA_20210819Resolution: 17μm, 638x437
AP-MALDI instrument demo test, mass spectrum scan in centroid mode. |
|
PE(22:2(13Z,16Z)/24:1(15Z)) Formula: C51H96NO8P (881.6873) Adducts: [M+H-H2O]+ (Ppm: 0.8) |
Rattus norvegicus (Brain) |
Spectroswiss - sol_2x_br_2Resolution: 17μm, 488x193
|
|
PE(22:2(13Z,16Z)/24:1(15Z)) Formula: C51H96NO8P (881.6873) Adducts: [M+H-H2O]+ (Ppm: 1.7) |
Mus musculus (Lung) |
image3Resolution: 40μm, 146x190
Fig. 4 MALDI-MSI data of mouse lung tissue after administration with D9-choline and U13C-DPPC–containing Poractant alfa surfactant (labels administered 12 h prior to tissue collection). 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-PC32:0+Na]+ (red) and [D9-PC32:0+Na]+ (green). Part-per-million (ppm) mass errors are indicated in parentheses. All images were visualized using total-ion-current normalization and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0. MSI, mass spectrometry imaging; PC, phosphatidylcholine; U13C-DPPC, universally 13C-labeled dipalmitoyl PC. |
|
m/z_864.6813 Formula: - (n/a) Adducts: (Ppm: 0) |
Mus musculus (Lung) |
image4Resolution: 40μm, 162x156
Fig 6c
Fig. 6 MALDI-MSI of U13C-PC16:0/16:0 acyl chain remodeling. A: Averaged MALDI mass spectrum from lung tissue collected from mice euthanized 12 h after administration of D9-choline and U13C-DPPC–containing Poractant alfa surfactant. The ion at m/z 828.6321 is assigned as the [M+Na]+ ion of 13C24-PC16:0_20:4 formed by acyl remodeling of U13C-PC16:0/16:0. The “NL” value refers to the intensity of the base peak in the full range MS1 spectrum. B: MS/MS spectrum of precursor ions at m/z 828.5 ± 0.5 with fragment ions originating from [13C24-PC16:0_20:4+Na]+ annotated. Part-per-million (ppm) mass errors are provided in parentheses. C, D: MALDI-MSI data of [U13C-DPPC+Na]+ (blue), [PC36:4+Na]+ (green) and [13C24-PC16:0_20:4+Na]+ (red) in lung tissue collected from mice (C) 12 h and (D) 18 h after label administration. All images were visualized using total-ion-current normalization and hotspot removal (high quantile = 99%). MS/MS, tandem mass spectrometry; MSI, mass spectrometry imaging; PC, phosphatidylcholine; U13C-DPPC, universally 13C-labeled dipalmitoyl PC. |
|
PE(22:2(13Z,16Z)/24:1(15Z)) Formula: C51H96NO8P (881.6873) Adducts: [M+H-H2O]+ (Ppm: 2.9) |
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. |
|
m/z_864.6828 Formula: - (n/a) Adducts: (Ppm: 0) |
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 |
|
PE(22:2(13Z,16Z)/24:1(15Z)) Formula: C51H96NO8P (881.6873) Adducts: [M+H-H2O]+ (Ppm: 3) |
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. |
|