M/Z: 752.5603
Hit 2 annotations: PE(P-18:0/20:4(5Z,8Z,11Z,14Z))_[M+H]+
; SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S))_[M-H2O+NH4]+
- 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 18 Reference Ions Near m/z 752.5603
NovoCell ID | m/z | Mass Window | Metabolite | Ranking | Anatomy Context |
---|---|---|---|---|---|
MSI_000006559 Reliable | 752.5602 | 752.56 ~ 752.5604 MzDiff: 1.5 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
5.08 (100%) | Rattus norvegicus [UBERON:0004358] caput epididymis |
MSI_000057875 Reliable | 752.5606 | 752.5604 ~ 752.561 MzDiff: 2.5 ppm |
SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) (BioDeep_00000215341) Formula: C42H77N2O7P (752.5468) |
10.59 (50%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000057823 Reliable | 752.5506 | 752.5501 ~ 752.551 MzDiff: 3.7 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
12.56 (64%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000043672 Reliable | 752.5523 | 752.552 ~ 752.5528 MzDiff: 3.0 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
8.13 (50%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000043199 Reliable | 752.5624 | 752.5622 ~ 752.5626 MzDiff: 1.8 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
5.15 (71%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000065105 Reliable | 752.5506 | 752.5502 ~ 752.5509 MzDiff: 3.0 ppm |
PA(18:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000188627) Formula: C39H75O10P (734.5098) |
6.44 (100%) | Homo sapiens [UBERON:0001155] colon |
MSI_000065154 Reliable | 752.5605 | 752.5601 ~ 752.5608 MzDiff: 2.8 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
5.46 (100%) | Homo sapiens [UBERON:0001155] colon |
MSI_000056929 Reliable | 752.5605 | 752.5603 ~ 752.5608 MzDiff: 1.9 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
1.41 (67%) | Homo sapiens [UBERON:0007779] transudate |
MSI_000043574 Unreliable | 752.5626 | 752.5626 ~ 752.5626 MzDiff: 0.1 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
2.59 (100%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000047106 Unreliable | 752.554 | 752.554 ~ 752.554 MzDiff: none |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
2.8 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
MSI_000047202 Unreliable | 752.561 | 752.561 ~ 752.561 MzDiff: none |
SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) (BioDeep_00000215341) Formula: C42H77N2O7P (752.5468) |
2.58 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
MSI_000047231 Unreliable | 752.5679 | 752.5679 ~ 752.5679 MzDiff: none |
DG(21:0/6 keto-PGF1alpha/0:0) (BioDeep_00000221490) Formula: C44H80O9 (752.5802) |
2.53 (100%) | Homo sapiens [UBERON:0013067] colorectal mucosa |
MSI_000052455 Unreliable | 752.5536 | 752.5536 ~ 752.5536 MzDiff: none |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
1.99 (100%) | Homo sapiens [UBERON:0001052] rectum |
MSI_000052491 Unreliable | 752.5606 | 752.5606 ~ 752.5606 MzDiff: none |
Not Annotated | 1.93 (0%) | Homo sapiens [UBERON:0001052] rectum |
MSI_000052525 Unreliable | 752.5658 | 752.5658 ~ 752.5658 MzDiff: none |
SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) (BioDeep_00000215341) Formula: C42H77N2O7P (752.5468) |
1.81 (100%) | Homo sapiens [UBERON:0001052] rectum |
MSI_000057848 Unreliable | 752.5583 | 752.5583 ~ 752.5584 MzDiff: 0.4 ppm |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
3.27 (50%) | Homo sapiens [UBERON:0001043] esophagus |
MSI_000056163 Unavailable | 752.5626 | 752.5626 ~ 752.5626 MzDiff: none |
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156) Formula: C43H78NO7P (751.5516) |
-0.57 (100%) | Homo sapiens [UBERON:0007779] transudate |
MSI_000056227 Unavailable | 752.5531 | 752.5531 ~ 752.5531 MzDiff: none |
SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) (BioDeep_00000215341) Formula: C42H77N2O7P (752.5468) |
-0.58 (100%) | Homo sapiens [UBERON:0007779] transudate |
Found 49 Sample Hits
Metabolite | Species | Sample | |
---|---|---|---|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 2.1) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito03_17Resolution: 17μm, 208x108
1 male adult wild-type rat was obtained from Inserm U1085 - Irset Research Institute (University of Rennes1, France). Animals were age 60 days and were reared under ad-lib conditions. Care and handling of all animals complied with EU directive 2010/63/EU on the protection of animals used for scientific purposes. The whole epididymis was excised from each animal immediately post-mortem, loosely wrapped rapidly in an aluminum foil and a 2.5% (w/v) carboxymethylcellulose (CMC) solution was poured to embed the epididymis to preserve their morphology. To remove air bubbles, the filled aluminum molds was gently freezed by depositing it on isopentane or dry ice, then on the nitrogen vapors and finally by progressively dipping the CMC/sample coated with aluminum foil into liquid nitrogen (or only flush with liquid nitrogen). Frozen tissues were stored at -80 °C until use to avoid degradation. |
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 2.1) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito03_18Resolution: 17μm, 208x104
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.7) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_43Resolution: 17μm, 298x106
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.9) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_44Resolution: 17μm, 299x111
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.5) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_46Resolution: 17μm, 298x106
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.5) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_47Resolution: 17μm, 301x111
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.5) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito08_48Resolution: 17μm, 294x107
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.7) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito01_04Resolution: 17μm, 178x91
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.4) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito01_03Resolution: 17μm, 159x110
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.8) |
Rattus norvegicus (normal) |
epik_dhb_head_ito01_05Resolution: 17μm, 183x105
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.8) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito01_06Resolution: 17μm, 183x103
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.8) |
Rattus norvegicus (Epididymis) |
epik_dhb_head_ito03_14Resolution: 17μm, 205x103
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 11.1) |
Homo sapiens (esophagus) |
LNTO22_1_3Resolution: 75μm, 121x68
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 0.6) |
Homo sapiens (esophagus) |
LNTO22_1_4Resolution: 17μm, 82x80
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 2.5) |
Homo sapiens (esophagus) |
LNTO29_16_2Resolution: 17μm, 95x101
|
|
SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 13.8) |
Homo sapiens (esophagus) |
TO42TResolution: 17μm, 69x81
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 5) |
Homo sapiens (esophagus) |
LNTO22_1_9Resolution: 75μm, 89x74
|
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 8.8) |
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. |
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 12.6) |
Homo sapiens (esophagus) |
LNTO30_8M_1Resolution: 17μm, 69x54
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1) |
Homo sapiens (esophagus) |
TO39TResolution: 17μm, 69x81
|
|
SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 12.1) |
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). |
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 3.1) |
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). |
|
m/z_752.5606 Formula: - (n/a) Adducts: (Ppm: 0) |
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). |
|
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 0.9) |
Homo sapiens (NA) |
160TopL,130TopR,150BottomL,140BottomR-profileResolution: 17μm, 142x136
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 12.9) |
Homo sapiens (esophagus) |
LNTO29_16_3Resolution: 17μm, 108x107
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 10.7) |
Homo sapiens (esophagus) |
LNTO26_7_1Resolution: 17μm, 75x74
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 5) |
Homo sapiens (esophagus) |
LNTO26_7_2Resolution: 17μm, 135x101
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 11.3) |
Homo sapiens (esophagus) |
LNTO26_7_3Resolution: 75μm, 82x88
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 15.6) |
Homo sapiens (esophagus) |
TO31TResolution: 75μm, 56x54
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 3.8) |
Homo sapiens (esophagus) |
TO29TResolution: 75μm, 56x48
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 2.1) |
Homo sapiens (esophagus) |
TO41TResolution: 75μm, 69x43
|
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m/z_752.561 Formula: - (n/a) Adducts: (Ppm: 0) |
Homo sapiens (esophagus) |
LNTO30_8M_2Resolution: 75μm, 108x68
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 12.9) |
Homo sapiens (esophagus) |
LNTO30_8M_3Resolution: 75μm, 69x54
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 12.3) |
Homo sapiens (esophagus) |
LNTO30_8M_5Resolution: 75μm, 56x54
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 12.1) |
Homo sapiens (esophagus) |
LNTO30_17_2Resolution: 75μm, 82x54
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 4.5) |
Homo sapiens (esophagus) |
LNTO22_1_5Resolution: 75μm, 135x94
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 11.3) |
Homo sapiens (esophagus) |
LNTO22_1_7Resolution: 75μm, 69x54
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 11.1) |
Homo sapiens (esophagus) |
LNTO22_1_8Resolution: 75μm, 69x61
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 3.1) |
Homo sapiens (esophagus) |
LNTO22_2_1Resolution: 75μm, 89x88
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 10.5) |
Homo sapiens (esophagus) |
LNTO22_2_2Resolution: 75μm, 135x94
|
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 10.7) |
Homo sapiens (esophagus) |
LNTO26_16_1Resolution: 75μm, 95x88
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SM(d17:1/20:3(5Z,8Z,11Z)-O(14R,15S)) Formula: C42H77N2O7P (752.5468) Adducts: [M-H2O+NH4]+ (Ppm: 12.9) |
Homo sapiens (esophagus) |
LNTO29_18_2Resolution: 75μm, 62x68
|
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m/z_752.5607 Formula: - (n/a) Adducts: (Ppm: 0) |
Homo sapiens (esophagus) |
LNTO30_7_1Resolution: 75μm, 69x68
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 2.3) |
Homo sapiens (esophagus) |
LNTO30_7_2Resolution: 75μm, 82x68
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.9) |
Homo sapiens (colorectal adenocarcinoma) |
240TopL, 210TopR, 230BottomL, 220BottomR-centroidResolution: 50μm, 142x141
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 2.6) |
Homo sapiens (colorectal adenocarcinoma) |
200TopL, 170TopR, 190BottomL, 180BottomR-centroidResolution: 50μm, 132x126
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 1.7) |
Homo sapiens (colorectal adenocarcinoma) |
160TopL,130TopR,150BottomL,140BottomR-centroidResolution: 50μm, 142x136
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 2.5) |
Homo sapiens (colorectal adenocarcinoma) |
120TopL, 90TopR, 110BottomL, 100BottomR-centroidResolution: 50μm, 132x136
|
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PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) Formula: C43H78NO7P (751.5516) Adducts: [M+H]+ (Ppm: 3.1) |
Drosophila melanogaster (brain) |
Drosophila18Resolution: 5μm, 686x685
Sample information
Organism: Drosophila melanogaster
Organism part: Brain
Condition: Healthy
Sample preparation
Sample stabilisation: Frozen
Tissue modification: Frozen
MALDI matrix: 2,5-dihydroxybenzoic acid (DHB)
MALDI matrix application: TM sprayer
Solvent: Aceton/water
MS analysis
Polarity: Positive
Ionisation source: Prototype
Analyzer: Orbitrap
Pixel size: 5μm × 5μm
Annotation settings
m/z tolerance (ppm): 3
Analysis version: Original MSM
Pixel count: 469910
Imzml file size: 696.23 MB
Ibd file size: 814.11 MB |
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