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 19 Reference Ions Near m/z 863.5736
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000057834 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000058313 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000058430 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000062050 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063018 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063407 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063661 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063712 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000064801 Reliable 863.5683 863.568 ~ 863.5689
MzDiff: 3.7 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
13.8 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043170 Reliable 863.5684 863.568 ~ 863.5689
MzDiff: 3.6 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
11.18 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043433 Reliable 863.5684 863.5681 ~ 863.5689
MzDiff: 3.6 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
5.68 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065096 Unreliable 863.5666 863.5663 ~ 863.567
MzDiff: 2.9 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
5.54 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047327 Unreliable 863.5649 863.5649 ~ 863.5649
MzDiff: none
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
2.38 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052452 Unreliable 863.5711 863.5711 ~ 863.5711
MzDiff: none
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
2 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000047355 Unreliable 863.5736 863.5736 ~ 863.5736
MzDiff: none
PA(24:1(15Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) (BioDeep_00000191445)
Formula: C49H83O10P (862.5724)
2.35 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052481 Unreliable 863.5793 863.5793 ~ 863.5793
MzDiff: none
Sodium aluminium phosphate (BioDeep_00000228359)
Formula: Al3NaO32P8 (863.5618)
1.95 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000047681 Unreliable 863.582 863.582 ~ 863.582
MzDiff: none
PS(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000104894)
Formula: C48H82NO10P (863.5676)
2.17 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000065357 Unreliable 863.5672 863.5672 ~ 863.5672
MzDiff: none
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
2.2 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000056080 Unavailable 863.5687 863.5687 ~ 863.5687
MzDiff: none
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
-0.54 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 5 Sample Hits
Metabolite Species Sample
PI(18:1/18:1)

Formula: C45H83O13P (862.5571)
Adducts: [M+H]+ (Ppm: 7.1)
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(24:1(15Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S))

Formula: C49H83O10P (862.5724)
Adducts: [M+H]+ (Ppm: 7)
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).

Sodium aluminium phosphate

Formula: Al3NaO32P8 (863.5618)
Adducts: [M-H2O+NH4]+ (Ppm: 9.1)
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).

PI(18:1/18:1)

Formula: C45H83O13P (862.5571)
Adducts: [M+H]+ (Ppm: 7.8)
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).

PI(18:1/18:1)

Formula: C45H83O13P (862.5571)
Adducts: [M+H]+ (Ppm: 4.4)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description