M/Z: 682.4065


Hit 2 annotations:  Phytolaccasaponin G_[M+NH4]+; S-(PGA1)-glutathione_[M+K]+


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 5 Reference Ions Near m/z 682.4065
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000046711 Reliable 682.4051 682.4051 ~ 682.4051
MzDiff: none
S-(PGA1)-glutathione (BioDeep_00000008592)
Formula: C30H49N3O10S (643.3138)
3.64 (100%) Mus musculus
[UBERON:0002107] liver
MSI_000043848 Unreliable 682.4015 682.4015 ~ 682.4015
MzDiff: none
Not Annotated 1.24 (0%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000021572 Unreliable 682.4065 682.4065 ~ 682.4065
MzDiff: none
Phytolaccasaponin G (BioDeep_00000003798)
Formula: C36H56O11 (664.3822)
0.81 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000050041 Unreliable 682.4053 682.4053 ~ 682.4053
MzDiff: none
Phytolaccasaponin G (BioDeep_00000003798)
Formula: C36H56O11 (664.3822)
1.08 (100%) Mytilus edulis
[UBERON:0009120] gill filament
MSI_000056023 Unavailable 682.4036 682.4036 ~ 682.4036
MzDiff: none
Phytolaccasaponin G (BioDeep_00000003798)
Formula: C36H56O11 (664.3822)
-0.5 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 7 Sample Hits
Metabolite Species Sample
Phytolaccasaponin G

Formula: C36H56O11 (664.3822)
Adducts: [M+NH4]+ (Ppm: 16.8)
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

Phytolaccasaponin G

Formula: C36H56O11 (664.3822)
Adducts: [M+NH4]+ (Ppm: 14)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

S-(PGA1)-glutathione

Formula: C30H49N3O10S (643.3138)
Adducts: [M+K]+ (Ppm: 8.1)
Mus musculus (Lung)
image5
Resolution: 40μm, 163x183

Description

Supplementary Figure S8. MALDI-MSI data of mouse lung tissue administered with D9-choline and U 13C-DPPC–containing Poractant alfa surfactant (labels administered 18 h prior to sacrifice). Ion images of (a) m/z 796.6856 ([U13C-DPPC+Na]+), (b) m/z 756.5154 [PC32:0+Na]+ and (c) m/z 765.6079 ([D9-PC32:0+Na]+). (d) Overlay image of [U13C-DPPC+Na]+ (red) and [D9-PC32:0+Na]+ (green). Parts per million (ppm) mass errors are indicated in parentheses. All images were visualised using totalion-current normalisation and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0.

S-(PGA1)-glutathione

Formula: C30H49N3O10S (643.3138)
Adducts: [M+K]+ (Ppm: 9.5)
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.

Phytolaccasaponin G

Formula: C36H56O11 (664.3822)
Adducts: [M+NH4]+ (Ppm: 15.8)
Mytilus edulis (gill)
20190202_MS38_Crassostrea_Gill_350-1500_DHB_pos_A25_11um_305x210
Resolution: 11μm, 305x210

Description

single cell layer class_4 is the gill structure cells, metabolite ion 534.2956 is the top representive ion of this type of cell

Phytolaccasaponin G

Formula: C36H56O11 (664.3822)
Adducts: [M+NH4]+ (Ppm: 18.3)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

Phytolaccasaponin G

Formula: C36H56O11 (664.3822)
Adducts: [M+NH4]+ (Ppm: 19.6)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description