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 12 Reference Ions Near m/z 464.322
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043082 Reliable 464.3154 464.3151 ~ 464.3159
MzDiff: 3.1 ppm
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
14.87 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043136 Reliable 464.3154 464.3152 ~ 464.3159
MzDiff: 2.9 ppm
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
4.4 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065141 Reliable 464.3144 464.3141 ~ 464.3146
MzDiff: 2.1 ppm
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
5.76 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000047415 Unreliable 464.322 464.322 ~ 464.322
MzDiff: none
Glycohyocholate (BioDeep_00000171453)
Formula: C26H42NO6- (464.3012)
2.31 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047617 Unreliable 464.3122 464.3122 ~ 464.3122
MzDiff: none
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
2.21 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000057263 Unreliable 464.3145 464.3144 ~ 464.3147
MzDiff: 1.0 ppm
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
0.85 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000056715 Unreliable 464.3132 464.313 ~ 464.3134
MzDiff: 1.6 ppm
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
2.94 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000044568 Unavailable 464.3272 464.3272 ~ 464.3272
MzDiff: none
Glycohyocholate (BioDeep_00000171453)
Formula: C26H42NO6- (464.3012)
-0.38 (100%) Rattus norvegicus
[UBERON:0002264] olfactory bulb
MSI_000049671 Unreliable 464.3135 464.3135 ~ 464.3135
MzDiff: none
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
1.68 (100%) Mytilus edulis
[UBERON:0009120] gill filament
MSI_000051070 Unreliable 464.3135 464.3135 ~ 464.3135
MzDiff: none
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
0.12 (100%) Mytilus edulis
[UBERON:2001856] gill ray
MSI_000056354 Unavailable 464.3158 464.3158 ~ 464.3158
MzDiff: none
LysoPE(18:0/0:0) (BioDeep_00000004204)
Formula: C23H48NO7P (481.3168)
-0.75 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000057144 Unreliable 464.3229 464.3229 ~ 464.3229
MzDiff: none
Glycohyocholate (BioDeep_00000171453)
Formula: C26H42NO6- (464.3012)
1.35 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 7 Sample Hits
Metabolite Species Sample
Glycohyocholate

Formula: C26H42NO6- (464.3012)
Adducts: [M-H2O+NH4]+ (Ppm: 3.4)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

LysoPE(18:0/0:0)

Formula: C23H48NO7P (481.3168)
Adducts: [M+H-H2O]+ (Ppm: 6.4)
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.

Glycohyocholate

Formula: C26H42NO6- (464.3012)
Adducts: [M-H2O+NH4]+ (Ppm: 5.3)
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).

1-(6-((3-Methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-1H-pyrrole-2,5-dione

Formula: C29H40N2O3 (464.3039)
Adducts: [M-H2O+NH4]+ (Ppm: 4.2)
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).

1-(6-((3-Methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-1H-pyrrole-2,5-dione

Formula: C29H40N2O3 (464.3039)
Adducts: [M-H2O+NH4]+ (Ppm: 4.4)
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).

LysoPE(18:0/0:0)

Formula: C23H48NO7P (481.3168)
Adducts: [M+H-H2O]+ (Ppm: 6)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

1-(6-((3-Methoxyestra-1,3,5(10)-trien-17-yl)amino)hexyl)-1H-pyrrole-2,5-dione

Formula: C29H40N2O3 (464.3039)
Adducts: [M-H2O+NH4]+ (Ppm: 6.5)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description