M/Z: 837.5489
Hit 3 annotations: Roxithromycin_[M+H]+
; PI(16:0/18:1(9Z))_[M+H]+
; PA(22:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S))_[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 17 Reference Ions Near m/z 837.5489
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000043088 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000055491 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000058425 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000062045 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000063013 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000063402 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000063656 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000063707 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000064796 Reliable | 837.5503 | 837.5501 ~ 837.5506 MzDiff: 2.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
10.28 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000065091 Reliable | 837.5486 | 837.5481 ~ 837.5489 MzDiff: 3.3 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
7.58 (71%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000065189 Reliable | 837.5497 | 837.549 ~ 837.55 MzDiff: 3.9 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
5 (100%) | Homo sapiens [UBERON:0001155] colon |
MSI_000058175 Unreliable | 837.5514 | 837.551 ~ 837.5516 MzDiff: 2.5 ppm |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
4.15 (80%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000047000 Unreliable | 837.5474 | 837.5474 ~ 837.5474 MzDiff: none |
Roxithromycin (BioDeep_00000001563) Formula: C41H76N2O15 (836.5245) |
3.04 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
MSI_000047006 Unreliable | 837.5394 | 837.5394 ~ 837.5394 MzDiff: none |
Amitenone (BioDeep_00000023078) Formula: C53H72O8 (836.5227) |
3.03 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
MSI_000047075 Unreliable | 837.5557 | 837.5557 ~ 837.5557 MzDiff: none |
PA(22:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) (BioDeep_00000190614) Formula: C47H81O10P (836.5567) |
2.87 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
MSI_000051817 Unreliable | 837.5468 | 837.5468 ~ 837.5468 MzDiff: none |
Roxithromycin (BioDeep_00000001563) Formula: C41H76N2O15 (836.5245) |
2.43 (100%) | Homo sapiens [UBERON:0001052] rectum |
MSI_000056169 Unavailable | 837.5503 | 837.5503 ~ 837.5503 MzDiff: none |
PI(16:0/18:1(9Z)) (BioDeep_00000004083) Formula: C43H81O13P (836.5415) |
-0.57 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 37 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M+H]+ (Ppm: 17.1) |
Mus musculus (Lung) |
image5Resolution: 40μm, 163x183
DescriptionSupplementary 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. |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.6) |
Homo sapiens (esophagus) |
LNTO22_1_3Resolution: 75μm, 121x68
Description |
|
Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M+H]+ (Ppm: 18.1) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.2) |
Homo sapiens (esophagus) |
LNTO29_16_2Resolution: 17μm, 95x101
Description |
|
Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M+H]+ (Ppm: 19.4) |
Homo sapiens (esophagus) |
TO42TResolution: 17μm, 69x81
Description |
|
PA(22:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) Formula: C47H81O10P (836.5567) Adducts: [M+H]+ (Ppm: 13) |
Homo sapiens (esophagus) |
LNTO22_1_9Resolution: 75μm, 89x74
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 4.2) |
Mus musculus (Liver) |
Salmonella_final_pos_recalResolution: 17μm, 691x430
DescriptionA 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. |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.7) |
Homo sapiens (esophagus) |
LNTO30_8M_1Resolution: 17μm, 69x54
Description |
|
Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M+H]+ (Ppm: 18.6) |
Homo sapiens (colorectal adenocarcinoma) |
80TopL, 50TopR, 70BottomL, 60BottomR-profileResolution: 17μm, 137x136
DescriptionThe 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). |
|
Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M+H]+ (Ppm: 17.9) |
Homo sapiens (colorectal adenocarcinoma) |
520TopL, 490TopR, 510BottomL, 500BottomR-profileResolution: 17μm, 147x131
DescriptionThe 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). |
|
Roxithromycin Formula: C41H76N2O15 (836.5245) Adducts: [M+H]+ (Ppm: 17.9) |
Homo sapiens (colorectal adenocarcinoma) |
439TopL, 409TopR, 429BottomL, 419BottomR-profileResolution: 17μm, 157x136
DescriptionThe 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(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.3) |
Homo sapiens (NA) |
160TopL,130TopR,150BottomL,140BottomR-profileResolution: 17μm, 142x136
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.2) |
Homo sapiens (esophagus) |
LNTO29_16_3Resolution: 17μm, 108x107
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.6) |
Homo sapiens (esophagus) |
LNTO26_7_1Resolution: 17μm, 75x74
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.9) |
Homo sapiens (esophagus) |
LNTO26_7_2Resolution: 17μm, 135x101
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.3) |
Homo sapiens (esophagus) |
LNTO26_7_3Resolution: 75μm, 82x88
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 2.2) |
Homo sapiens (esophagus) |
TO31TResolution: 75μm, 56x54
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 2.7) |
Homo sapiens (esophagus) |
TO29TResolution: 75μm, 56x48
Description |
|
PA(22:0/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) Formula: C47H81O10P (836.5567) Adducts: [M+H]+ (Ppm: 15.4) |
Homo sapiens (esophagus) |
TO41TResolution: 75μm, 69x43
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.7) |
Homo sapiens (esophagus) |
LNTO30_8M_2Resolution: 75μm, 108x68
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.8) |
Homo sapiens (esophagus) |
LNTO30_8M_3Resolution: 75μm, 69x54
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.9) |
Homo sapiens (esophagus) |
LNTO30_8M_4Resolution: 75μm, 62x48
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.8) |
Homo sapiens (esophagus) |
LNTO30_8M_5Resolution: 75μm, 56x54
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.8) |
Homo sapiens (esophagus) |
LNTO30_17_2Resolution: 75μm, 82x54
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 2) |
Homo sapiens (esophagus) |
LNTO22_1_5Resolution: 75μm, 135x94
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 3.2) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.8) |
Homo sapiens (esophagus) |
LNTO22_1_8Resolution: 75μm, 69x61
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 3.4) |
Homo sapiens (esophagus) |
LNTO22_2_1Resolution: 75μm, 89x88
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 2.1) |
Homo sapiens (esophagus) |
LNTO22_2_2Resolution: 75μm, 135x94
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.3) |
Homo sapiens (esophagus) |
LNTO26_16_1Resolution: 75μm, 95x88
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.2) |
Homo sapiens (esophagus) |
LNTO29_18_2Resolution: 75μm, 62x68
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.7) |
Homo sapiens (esophagus) |
LNTO30_7_1Resolution: 75μm, 69x68
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.2) |
Homo sapiens (esophagus) |
LNTO30_7_2Resolution: 75μm, 82x68
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.5) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.5) |
Homo sapiens (colorectal adenocarcinoma) |
200TopL, 170TopR, 190BottomL, 180BottomR-centroidResolution: 50μm, 132x126
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 0.3) |
Homo sapiens (colorectal adenocarcinoma) |
160TopL,130TopR,150BottomL,140BottomR-centroidResolution: 50μm, 142x136
Description |
|
PI(16:0/18:1(9Z)) Formula: C43H81O13P (836.5415) Adducts: [M+H]+ (Ppm: 1.5) |
Homo sapiens (colorectal adenocarcinoma) |
120TopL, 90TopR, 110BottomL, 100BottomR-centroidResolution: 50μm, 132x136
Description |
|