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 4 Reference Ions Near m/z 687.5039
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000046486 Reliable 687.4976 687.4976 ~ 687.4976
MzDiff: none
DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) (BioDeep_00000028917)
Formula: C45H66O5 (686.491)
4.42 (100%) Mus musculus
[UBERON:0002107] liver
MSI_000057842 Reliable 687.4973 687.4971 ~ 687.4976
MzDiff: 2.0 ppm
DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) (BioDeep_00000028917)
Formula: C45H66O5 (686.491)
5.29 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065737 Unreliable 687.4977 687.4974 ~ 687.4978
MzDiff: 1.6 ppm
DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) (BioDeep_00000028917)
Formula: C45H66O5 (686.491)
1.5 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000055889 Unavailable 687.5088 687.5088 ~ 687.5088
MzDiff: none
DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0) (BioDeep_00000028917)
Formula: C45H66O5 (686.491)
-0.3 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 8 Sample Hits
Metabolite Species Sample
Cer(d18:0/LTE4)

Formula: C41H74N2O6S (722.5267)
Adducts: [M+H-2H2O]+ (Ppm: 13.1)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)

Formula: C45H66O5 (686.491)
Adducts: [M+H]+ (Ppm: 1.5)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)

Formula: C45H66O5 (686.491)
Adducts: [M+H]+ (Ppm: 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.

DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)

Formula: C45H66O5 (686.491)
Adducts: [M+H]+ (Ppm: 15.3)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)

Formula: C45H66O5 (686.491)
Adducts: [M+H]+ (Ppm: 1.4)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

DG(19:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)/0:0)

Formula: C42H72O8 (704.5227)
Adducts: [M+H-H2O]+ (Ppm: 17.9)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)

Formula: C45H66O5 (686.491)
Adducts: [M+H]+ (Ppm: 3.1)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

DG(20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)

Formula: C45H66O5 (686.491)
Adducts: [M+H]+ (Ppm: 0.7)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description