M/Z: 325.1844
Hit 5 annotations: Cortisone_[M+H-2H2O]+
; Escitalopram_[M+H]+
; Quinine_[M+H]+
; Monocrotaline_[M-H2O+NH4]+
; Piperonyl sulfoxide_[M+H]+
- 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 22 Reference Ions Near m/z 325.1844
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000064730 Reliable | 325.1838 | 325.1835 ~ 325.184 MzDiff: 2.1 ppm |
Cortisone (BioDeep_00000001526) Formula: C21H28O5 (360.1937) |
7.41 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000052730 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000053100 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000056652 Reliable | 325.1915 | 325.1912 ~ 325.1916 MzDiff: 1.9 ppm |
Quinine (BioDeep_00000002037) Formula: C20H24N2O2 (324.1838) |
4.06 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000058225 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000058397 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000061078 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000062913 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000063069 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000063476 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000063679 Reliable | 325.1851 | 325.185 ~ 325.1852 MzDiff: 0.7 ppm |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
6.02 (70%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000053383 Reliable | 325.1935 | 325.1934 ~ 325.1935 MzDiff: 0.2 ppm |
iso-OMPA (BioDeep_00000180123) Formula: C12H32N4O3P2 (342.195) |
3.93 (67%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000045882 Reliable | 325.1775 | 325.1775 ~ 325.1775 MzDiff: none |
Escitalopram (BioDeep_00000017867) Formula: C20H21FN2O (324.1638) |
8.78 (100%) | Mus musculus [UBERON:0002107] liver |
MSI_000053452 Reliable | 325.1768 | 325.1767 ~ 325.1769 MzDiff: 1.0 ppm |
Escitalopram (BioDeep_00000017867) Formula: C20H21FN2O (324.1638) |
4.34 (62%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000053159 Unreliable | 325.1866 | 325.1866 ~ 325.1866 MzDiff: none |
Quinine (BioDeep_00000002037) Formula: C20H24N2O2 (324.1838) |
2.9 (100%) | DESI [NOVOCELL:BACKGROUND] blank |
MSI_000032161 Unreliable | 325.1774 | 325.1771 ~ 325.1778 MzDiff: 2.7 ppm |
Monocrotaline (BioDeep_00000002079) Formula: C16H23NO6 (325.1525) |
3.82 (100%) | Posidonia oceanica [PO:0005020] vascular bundle |
MSI_000013124 Unavailable | 325.1775 | 325.1775 ~ 325.1775 MzDiff: none |
Cortisone (BioDeep_00000001526) Formula: C21H28O5 (360.1937) |
-0.72 (100%) | Plant [PO:0005020] vascular bundle |
MSI_000013768 Unreliable | 325.1775 | 325.1775 ~ 325.1775 MzDiff: none |
Cortisone (BioDeep_00000001526) Formula: C21H28O5 (360.1937) |
0.18 (100%) | Plant [PO:0005417] phloem |
MSI_000015258 Unavailable | 325.1775 | 325.1775 ~ 325.1775 MzDiff: none |
Cortisone (BioDeep_00000001526) Formula: C21H28O5 (360.1937) |
-0.65 (100%) | Plant [PO:0006036] root epidermis |
MSI_000018644 Unreliable | 325.1775 | 325.1775 ~ 325.1775 MzDiff: none |
Cortisone (BioDeep_00000001526) Formula: C21H28O5 (360.1937) |
1.67 (100%) | Plant [PO:0020124] root stele |
MSI_000019854 Unavailable | 325.1775 | 325.1775 ~ 325.1775 MzDiff: none |
Cortisone (BioDeep_00000001526) Formula: C21H28O5 (360.1937) |
-0.48 (100%) | Plant [PO:0025197] stele |
MSI_000055834 Unavailable | 325.1852 | 325.1852 ~ 325.1852 MzDiff: none |
Piperonyl sulfoxide (BioDeep_00000012643) Formula: C18H28O3S (324.1759) |
-0.06 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 36 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15.3) |
Homo sapiens (esophagus) |
LNTO22_1_3Resolution: 75μm, 121x68
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 11.3) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 14.4) |
Homo sapiens (esophagus) |
LNTO29_16_2Resolution: 17μm, 95x101
|
|
Escitalopram Formula: C20H21FN2O (324.1638) Adducts: [M+H]+ (Ppm: 19.8) |
Mus musculus (Liver) |
Salmonella_final_pos_recalResolution: 17μm, 691x430
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. |
|
Quinine Formula: C20H24N2O2 (324.1838) Adducts: [M+H]+ (Ppm: 18.3) |
Homo sapiens (esophagus) |
LNTO22_1_9Resolution: 75μm, 89x74
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 13.8) |
Homo sapiens (esophagus) |
LNTO30_8M_1Resolution: 17μm, 69x54
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 12.9) |
Homo sapiens (esophagus) |
TO39TResolution: 17μm, 69x81
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 6.2) |
Homo sapiens (colorectal adenocarcinoma) |
80TopL, 50TopR, 70BottomL, 60BottomR-profileResolution: 17μm, 137x136
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). |
|
Quinine Formula: C20H24N2O2 (324.1838) Adducts: [M+H]+ (Ppm: 13.7) |
Homo sapiens (colorectal adenocarcinoma) |
80TopL, 50TopR, 70BottomL, 60BottomR-profileResolution: 17μm, 137x136
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). |
|
Monocrotaline Formula: C16H23NO6 (325.1525) Adducts: [M-H2O+NH4]+ (Ppm: 6.5) |
Homo sapiens (colorectal adenocarcinoma) |
520TopL, 490TopR, 510BottomL, 500BottomR-profileResolution: 17μm, 147x131
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). |
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15.3) |
Homo sapiens (colorectal adenocarcinoma) |
520TopL, 490TopR, 510BottomL, 500BottomR-profileResolution: 17μm, 147x131
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). |
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 5.8) |
Homo sapiens (colorectal adenocarcinoma) |
439TopL, 409TopR, 429BottomL, 419BottomR-profileResolution: 17μm, 157x136
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). |
|
Monocrotaline Formula: C16H23NO6 (325.1525) Adducts: [M-H2O+NH4]+ (Ppm: 8.3) |
Homo sapiens (NA) |
160TopL,130TopR,150BottomL,140BottomR-profileResolution: 17μm, 142x136
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15) |
Homo sapiens (NA) |
160TopL,130TopR,150BottomL,140BottomR-profileResolution: 17μm, 142x136
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15.3) |
Homo sapiens (esophagus) |
LNTO26_7_1Resolution: 17μm, 75x74
|
|
Piperonyl sulfoxide Formula: C18H28O3S (324.1759) Adducts: [M+H]+ (Ppm: 6.2) |
Homo sapiens (esophagus) |
LNTO26_7_2Resolution: 17μm, 135x101
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15) |
Homo sapiens (esophagus) |
LNTO26_7_3Resolution: 75μm, 82x88
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 11.3) |
Homo sapiens (esophagus) |
TO40TResolution: 17μm, 82x74
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 13.8) |
Homo sapiens (esophagus) |
TO31TResolution: 75μm, 56x54
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15.3) |
Homo sapiens (esophagus) |
TO29TResolution: 75μm, 56x48
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 13.8) |
Homo sapiens (esophagus) |
TO41TResolution: 75μm, 69x43
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 14.1) |
Homo sapiens (esophagus) |
LNTO30_8M_2Resolution: 75μm, 108x68
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 13.8) |
Homo sapiens (esophagus) |
LNTO30_8M_3Resolution: 75μm, 69x54
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 14.7) |
Homo sapiens (esophagus) |
LNTO30_8M_4Resolution: 75μm, 62x48
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 14.4) |
Homo sapiens (esophagus) |
LNTO30_8M_5Resolution: 75μm, 56x54
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15.3) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15) |
Homo sapiens (esophagus) |
LNTO22_1_8Resolution: 75μm, 69x61
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 15.3) |
Homo sapiens (esophagus) |
LNTO22_2_1Resolution: 75μm, 89x88
|
|
Piperonyl sulfoxide Formula: C18H28O3S (324.1759) Adducts: [M+H]+ (Ppm: 5.9) |
Homo sapiens (esophagus) |
LNTO22_2_2Resolution: 75μm, 135x94
|
|
Piperonyl sulfoxide Formula: C18H28O3S (324.1759) Adducts: [M+H]+ (Ppm: 5.3) |
Homo sapiens (esophagus) |
LNTO26_16_1Resolution: 75μm, 95x88
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 13.5) |
Homo sapiens (esophagus) |
LNTO29_18_2Resolution: 75μm, 62x68
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 14.1) |
Homo sapiens (esophagus) |
LNTO30_7_1Resolution: 75μm, 69x68
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 13.8) |
Homo sapiens (esophagus) |
LNTO30_7_2Resolution: 75μm, 82x68
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 12.9) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 14.1) |
Homo sapiens (colorectal adenocarcinoma) |
200TopL, 170TopR, 190BottomL, 180BottomR-centroidResolution: 50μm, 132x126
|
|
Cortisone Formula: C21H28O5 (360.1937) Adducts: [M+H-2H2O]+ (Ppm: 12.9) |
Homo sapiens (colorectal adenocarcinoma) |
160TopL,130TopR,150BottomL,140BottomR-centroidResolution: 50μm, 142x136
|
|