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 11 Reference Ions Near m/z 765.5191
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043631 Reliable 765.5285 765.5283 ~ 765.529
MzDiff: 2.7 ppm
Narasin (BioDeep_00000017926)
Formula: C43H72O11 (764.5074)
14.09 (58%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043242 Reliable 765.5274 765.5271 ~ 765.5277
MzDiff: 2.8 ppm
PE(16:0/22:5(4Z,7Z,10Z,13Z,16Z)) (BioDeep_00000018578)
Formula: C43H76NO8P (765.5308)
18.44 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047131 Unreliable 765.5241 765.5241 ~ 765.5241
MzDiff: none
Narasin (BioDeep_00000017926)
Formula: C43H72O11 (764.5074)
2.75 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047221 Unreliable 765.517 765.517 ~ 765.517
MzDiff: none
PA(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000188649)
Formula: C43H73O9P (764.4992)
2.54 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051776 Unreliable 765.5183 765.5183 ~ 765.5183
MzDiff: none
Clarithromycin (BioDeep_00000002154)
Formula: C38H69NO13 (747.4769)
2.46 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000051802 Unreliable 765.5272 765.5272 ~ 765.5272
MzDiff: none
Narasin (BioDeep_00000017926)
Formula: C43H72O11 (764.5074)
2.44 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052217 Unreliable 765.513 765.513 ~ 765.513
MzDiff: none
Not Annotated 2.27 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000056731 Unreliable 765.5252 765.525 ~ 765.5255
MzDiff: 1.8 ppm
PA(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000107676)
Formula: C47H77O8P (800.5356)
2.93 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065251 Unreliable 765.5268 765.5268 ~ 765.5268
MzDiff: none
PA(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000107676)
Formula: C47H77O8P (800.5356)
1.59 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000049590 Unreliable 765.5105 765.5105 ~ 765.5105
MzDiff: none
Narasin (BioDeep_00000017926)
Formula: C43H72O11 (764.5074)
1.83 (100%) Mytilus edulis
[UBERON:0009120] gill filament
MSI_000051003 Unreliable 765.5105 765.5105 ~ 765.5105
MzDiff: none
Narasin (BioDeep_00000017926)
Formula: C43H72O11 (764.5074)
0.33 (100%) Mytilus edulis
[UBERON:2001856] gill ray

Found 9 Sample Hits
Metabolite Species Sample
Narasin

Formula: C43H72O11 (764.5074)
Adducts: [M+H]+ (Ppm: 5.7)
Mus musculus (Lung)
image1
Resolution: 40μm, 187x165

Description

Fig. 2 MALDI-MSI data from the same mouse lung tissue analyzed in Fig. 1. A: Optical image of the post-MSI, H&E-stained tissue section. B–D, F–G: Ion images of (B) m/z 796.6855 ([U13C-DPPC+Na]+), (C) m/z 756.5514 ([PC32:0+Na]+), (D) m/z 765.6079 ([D9-PC32:0+Na]+), (F) m/z 754.5359 ([PC32:1+Na]+), and (G) m/z 763.5923 ([D9-PC32:1+Na]+). E, H: Ratio images of (E) [D9-PC32:0+Na]+:[PC32:0+Na]+ and (H) [D9-PC32:1+Na]+:[PC32:1+Na]+. 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. U13C-DPPC, universally 13C-labeled dipalmitoyl PC; PC, phosphatidylcholine; MSI, mass spectrometry imaging; H&E, hematoxylin and eosin. Fig 1-3, Fig S1-S3, S5

Narasin

Formula: C43H72O11 (764.5074)
Adducts: [M+H]+ (Ppm: 16.4)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

Narasin

Formula: C43H72O11 (764.5074)
Adducts: [M+H]+ (Ppm: 7.7)
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.

PA(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C43H73O9P (764.4992)
Adducts: [M+H]+ (Ppm: 13.8)
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(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C43H73O9P (764.4992)
Adducts: [M+H]+ (Ppm: 13.9)
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).

Clarithromycin

Formula: C38H69NO13 (747.4769)
Adducts: [M+NH4]+ (Ppm: 9.9)
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).

Narasin

Formula: C43H72O11 (764.5074)
Adducts: [M+H]+ (Ppm: 10.2)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PE(16:0/22:5(4Z,7Z,10Z,13Z,16Z))

Formula: C43H76NO8P (765.5308)
Adducts: [M]+ (Ppm: 3.9)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

PA(22:2(13Z,16Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H77O8P (800.5356)
Adducts: [M+H-2H2O]+ (Ppm: 2.2)
Drosophila melanogaster (brain)
Drosophila18
Resolution: 5μm, 686x685

Description

Sample information Organism: Drosophila melanogaster Organism part: Brain Condition: Healthy Sample preparation Sample stabilisation: Frozen Tissue modification: Frozen MALDI matrix: 2,5-dihydroxybenzoic acid (DHB) MALDI matrix application: TM sprayer Solvent: Aceton/water MS analysis Polarity: Positive Ionisation source: Prototype Analyzer: Orbitrap Pixel size: 5μm × 5μm Annotation settings m/z tolerance (ppm): 3 Analysis version: Original MSM Pixel count: 469910 Imzml file size: 696.23 MB Ibd file size: 814.11 MB