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 10 Reference Ions Near m/z 328.0449
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000053755 Unreliable 328.0516 328.0512 ~ 328.0518
MzDiff: 2.5 ppm
Aflatoxin M1 (BioDeep_00000001285)
Formula: C17H12O7 (328.0583)
3.22 (80%) MALDI - CHCA
[NOVOCELL:BACKGROUND] blank
MSI_000052591 Unreliable 328.0543 328.0543 ~ 328.0543
MzDiff: none
Flufenacet (BioDeep_00000001156)
Formula: C14H13F4N3O2S (363.0665)
1.44 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000053447 Unreliable 328.0408 328.0408 ~ 328.0408
MzDiff: none
Not Annotated 2.47 (0%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000065882 Unreliable 328.0452 328.0451 ~ 328.0454
MzDiff: 1.6 ppm
Guanosine monophosphate (BioDeep_00000003009)
Formula: C10H14N5O8P (363.058)
1.33 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000012818 Unavailable 328.0508 328.0508 ~ 328.0508
MzDiff: none
Flufenacet (BioDeep_00000001156)
Formula: C14H13F4N3O2S (363.0665)
-0.48 (100%) Plant
[PO:0005020] vascular bundle
MSI_000014060 Unavailable 328.0508 328.0508 ~ 328.0508
MzDiff: none
Flufenacet (BioDeep_00000001156)
Formula: C14H13F4N3O2S (363.0665)
-0.27 (100%) Plant
[PO:0005417] phloem
MSI_000014988 Unavailable 328.0508 328.0508 ~ 328.0508
MzDiff: none
Flufenacet (BioDeep_00000001156)
Formula: C14H13F4N3O2S (363.0665)
-0.51 (100%) Plant
[PO:0006036] root epidermis
MSI_000018376 Unreliable 328.0508 328.0508 ~ 328.0508
MzDiff: none
Flufenacet (BioDeep_00000001156)
Formula: C14H13F4N3O2S (363.0665)
1.78 (100%) Plant
[PO:0020124] root stele
MSI_000020036 Unavailable 328.0508 328.0508 ~ 328.0508
MzDiff: none
Flufenacet (BioDeep_00000001156)
Formula: C14H13F4N3O2S (363.0665)
-0.51 (100%) Plant
[PO:0025197] stele
MSI_000034038 Unreliable 328.0518 328.0518 ~ 328.0518
MzDiff: none
Aflatoxin M1 (BioDeep_00000001285)
Formula: C17H12O7 (328.0583)
0.05 (100%) Posidonia oceanica
[PO:0005352] xylem

Found 8 Sample Hits
Metabolite Species Sample
Guanosine monophosphate

Formula: C10H14N5O8P (363.058)
Adducts: [M+H-2H2O]+ (Ppm: 2.9)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

Flufenacet

Formula: C14H13F4N3O2S (363.0665)
Adducts: [M+H-2H2O]+ (Ppm: 6.7)
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.

Guanosine monophosphate

Formula: C10H14N5O8P (363.058)
Adducts: [M+H-2H2O]+ (Ppm: 2.3)
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).

Guanosine monophosphate

Formula: C10H14N5O8P (363.058)
Adducts: [M+H-2H2O]+ (Ppm: 7.1)
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).

4-[(2-Hydroxy-1-naphthalenyl)azo]benzenesulfonic acid

Formula: C16H12N2O4S (328.0518)
Adducts: [M]+ (Ppm: 1.4)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

Guanosine monophosphate

Formula: C10H14N5O8P (363.058)
Adducts: [M+H-2H2O]+ (Ppm: 2.9)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

Guanosine monophosphate

Formula: C10H14N5O8P (363.058)
Adducts: [M+H-2H2O]+ (Ppm: 3.8)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

Guanosine monophosphate

Formula: C10H14N5O8P (363.058)
Adducts: [M+H-2H2O]+ (Ppm: 3.2)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description