在BioDeep NovoCell知识数据库中,参考离子总共被划分为4个级别。
  • 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 18 Reference Ions Near m/z 751.537
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043885 Reliable 751.5294 751.529 ~ 751.5297
MzDiff: 2.5 ppm
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
7.49 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000046609 Reliable 751.547 751.547 ~ 751.547
MzDiff: none
PG(16:0/18:0) (BioDeep_00000019281)
Formula: C40H79O10P (750.5411)
3.94 (100%) Mus musculus
[UBERON:0002107] liver
MSI_000046873 Reliable 751.5275 751.527 ~ 751.5278
MzDiff: 3.3 ppm
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
8.02 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000046934 Unreliable 751.5408 751.5408 ~ 751.5408
MzDiff: none
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
3.12 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047065 Unreliable 751.5287 751.5287 ~ 751.5287
MzDiff: none
1,28-Dicaffeoyloctacosanediol (BioDeep_00000024304)
Formula: C46H70O8 (750.507)
2.89 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047153 Unreliable 751.5339 751.5339 ~ 751.5339
MzDiff: none
Not Annotated 2.69 (0%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051955 Unreliable 751.5439 751.5439 ~ 751.5439
MzDiff: none
SM(d17:1/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000215366)
Formula: C42H75N2O7P (750.5312)
2.37 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052531 Unreliable 751.537 751.537 ~ 751.537
MzDiff: none
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
1.78 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000065312 Unreliable 751.5281 751.5281 ~ 751.5281
MzDiff: none
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
2.18 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000029423 Unreliable 751.5347 751.5347 ~ 751.5347
MzDiff: none
PG(16:0/18:0) (BioDeep_00000019281)
Formula: C40H79O10P (750.5411)
0.95 (100%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000030194 Unreliable 751.529 751.529 ~ 751.529
MzDiff: none
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
2.13 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000030843 Unreliable 751.5347 751.5347 ~ 751.5347
MzDiff: none
PG(16:0/18:0) (BioDeep_00000019281)
Formula: C40H79O10P (750.5411)
0.82 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000031462 Unreliable 751.5347 751.5347 ~ 751.5347
MzDiff: none
PG(16:0/18:0) (BioDeep_00000019281)
Formula: C40H79O10P (750.5411)
0.67 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000031620 Unreliable 751.529 751.529 ~ 751.529
MzDiff: none
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
0.16 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000056233 Unavailable 751.5304 751.5304 ~ 751.5304
MzDiff: none
PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107296)
Formula: C43H75O8P (750.5199)
-0.58 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000061569 Unavailable 751.536 751.536 ~ 751.536
MzDiff: none
PG(16:0/18:0) (BioDeep_00000019281)
Formula: C40H79O10P (750.5411)
-0.35 (100%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000062395 Unavailable 751.536 751.536 ~ 751.536
MzDiff: none
PG(16:0/18:0) (BioDeep_00000019281)
Formula: C40H79O10P (750.5411)
-0.35 (100%) Mus musculus
[UBERON:0001950] neocortex
MSI_000062825 Unavailable 751.536 751.536 ~ 751.536
MzDiff: none
PG(16:0/18:0) (BioDeep_00000019281)
Formula: C40H79O10P (750.5411)
-0.35 (100%) Mus musculus
[UBERON:0002421] hippocampal formation

Found 10 Sample Hits
Metabolite Species Sample
SM(d17:1/20:4(6E,8Z,11Z,14Z)+=O(5))

Formula: C42H75N2O7P (750.5312)
Adducts: [M+H]+ (Ppm: 11.6)
Mus musculus (Lung)
image3
Resolution: 40μm, 146x190

Description

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.

SM(d17:1/20:4(6E,8Z,11Z,14Z)+=O(5))

Formula: C42H75N2O7P (750.5312)
Adducts: [M+H]+ (Ppm: 10.8)
Mus musculus (Lung)
image2
Resolution: 40μm, 550x256

Description

Supplementary Figure S6. Ion distribution images for (a) [PC36:4+Na]+ (m/z 804.5514) and (b) [PC38:6+Na]+ (m/z 828.5515) obtained from mouse lung tissue collected 6 h after administration of D9- choline and U13C-DPPC–containing CHF5633. Parts-per-million (ppm) mass errors are indicated in parentheses. (c) Magnification of the boxed region in (a) with selected bronchiolar regions outlined in white boxes. (d) The corresponding H&E-stained tissue section with the same selected bronchiolar regions outlined in black boxes. These data demonstrate the co-localisation of the polyunsaturated lipids PC36:4 and PC38:6 with the bronchiolar regions of the lung. All MSI images were visualised using total ion current normalisation and hotspot removal (high quantile = 99%).

PG(16:0/18:0)

Formula: C40H79O10P (750.5411)
Adducts: [M+H]+ (Ppm: 18.1)
Macropus giganteus (Brain)
170321_kangaroobrain-dan3-pos_maxof50.0_med1
Resolution: 50μm, 81x50

Description

Sample information Organism: Macropus giganteus (kangaroo) Organism part: Brain Condition: Wildtype Sample growth conditions: Wild

PG(16:0/18:0)

Formula: C40H79O10P (750.5411)
Adducts: [M+H]+ (Ppm: 1.8)
Mus musculus (Liver)
Salmonella_final_pos_recal
Resolution: 17μm, 691x430

Description

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.

m/z_751.5339

Formula: - (n/a)
Adducts: (Ppm: 0)
Homo sapiens (colorectal adenocarcinoma)
80TopL, 50TopR, 70BottomL, 60BottomR-profile
Resolution: 17μm, 137x136

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z))

Formula: C43H75O8P (750.5199)
Adducts: [M+H]+ (Ppm: 18.1)
Homo sapiens (colorectal adenocarcinoma)
80TopL, 50TopR, 70BottomL, 60BottomR-profile
Resolution: 17μm, 137x136

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z))

Formula: C43H75O8P (750.5199)
Adducts: [M+H]+ (Ppm: 13.8)
Homo sapiens (colorectal adenocarcinoma)
520TopL, 490TopR, 510BottomL, 500BottomR-profile
Resolution: 17μm, 147x131

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z))

Formula: C43H75O8P (750.5199)
Adducts: [M+H]+ (Ppm: 13)
Homo sapiens (colorectal adenocarcinoma)
439TopL, 409TopR, 429BottomL, 419BottomR-profile
Resolution: 17μm, 157x136

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

PA(18:1(9Z)/22:4(7Z,10Z,13Z,16Z))

Formula: C43H75O8P (750.5199)
Adducts: [M+H]+ (Ppm: 16.1)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PG(16:0/18:0)

Formula: C40H79O10P (750.5411)
Adducts: [M+H]+ (Ppm: 16.4)
Mus musculus (brain)
Brain01_Bregma1-42_02_centroid
Resolution: 17μm, 434x258

Description