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 7 Reference Ions Near m/z 408.015
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000027270 Unreliable 408.0075 408.0073 ~ 408.0076
MzDiff: 1.3 ppm
Guanosine diphosphate (BioDeep_00000001615)
Formula: C10H15N5O11P2 (443.0243)
2.68 (100%) Mus musculus
[UBERON:0000913] interstitial fluid
MSI_000060194 Unreliable 408.0076 408.0076 ~ 408.0076
MzDiff: 0.1 ppm
Guanosine diphosphate (BioDeep_00000001615)
Formula: C10H15N5O11P2 (443.0243)
2.25 (100%) Mus musculus
[UBERON:0002421] hippocampal formation
MSI_000049648 Unreliable 408.0083 408.0083 ~ 408.0083
MzDiff: none
Guanosine diphosphate (BioDeep_00000001615)
Formula: C10H15N5O11P2 (443.0243)
1.72 (100%) Mytilus edulis
[UBERON:0009120] gill filament
MSI_000050934 Unreliable 408.0083 408.0083 ~ 408.0083
MzDiff: none
Guanosine diphosphate (BioDeep_00000001615)
Formula: C10H15N5O11P2 (443.0243)
0.56 (100%) Mytilus edulis
[UBERON:2001856] gill ray
MSI_000058967 Unavailable 408.0076 408.0076 ~ 408.0076
MzDiff: none
Guanosine diphosphate (BioDeep_00000001615)
Formula: C10H15N5O11P2 (443.0243)
-0.05 (100%) Mus musculus
[UBERON:0001950] neocortex
MSI_000059790 Unavailable 408.0082 408.0082 ~ 408.0082
MzDiff: none
Guanosine diphosphate (BioDeep_00000001615)
Formula: C10H15N5O11P2 (443.0243)
-0.56 (100%) Mus musculus
[UBERON:0002298] brainstem
MSI_000061457 Unavailable 408.0087 408.0087 ~ 408.0087
MzDiff: none
Guanosine diphosphate (BioDeep_00000001615)
Formula: C10H15N5O11P2 (443.0243)
-0.18 (100%) Mus musculus
[UBERON:0000956] cerebral cortex

Found 6 Sample Hits
Metabolite Species Sample
Guanosine diphosphate

Formula: C10H15N5O11P2 (443.0243)
Adducts: [M+H-2H2O]+ (Ppm: 7.8)
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.

Guanosine diphosphate

Formula: C10H15N5O11P2 (443.0243)
Adducts: [M+H-2H2O]+ (Ppm: 7)
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%).

Guanosine diphosphate

Formula: C10H15N5O11P2 (443.0243)
Adducts: [M+H-2H2O]+ (Ppm: 5.8)
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.

Guanosine diphosphate

Formula: C10H15N5O11P2 (443.0243)
Adducts: [M+H-2H2O]+ (Ppm: 11.1)
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).

(-)-Epigallocatechin sulfate

Formula: C15H13O10S- (385.0229)
Adducts: [M+Na]+ (Ppm: 8.9)
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).

Guanosine diphosphate

Formula: C10H15N5O11P2 (443.0243)
Adducts: [M+H-2H2O]+ (Ppm: 5.6)
Mus musculus (brain)
Brain01_Bregma-3-88b_centroid
Resolution: 17μm, 265x320

Description