M/Z: 839.5637


Hit 1 annotations:  PI(16:0/18:0)_[M+H]+


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 10 Reference Ions Near m/z 839.5637
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000056687 Reliable 839.5644 839.5642 ~ 839.565
MzDiff: 3.3 ppm
PI(16:0/18:0) (BioDeep_00000019301)
Formula: C43H83O13P (838.5571)
13.5 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043361 Reliable 839.5663 839.5661 ~ 839.5667
MzDiff: 2.4 ppm
PI(16:0/18:0) (BioDeep_00000019301)
Formula: C43H83O13P (838.5571)
7.11 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000011287 Unreliable 839.5674 839.5674 ~ 839.5674
MzDiff: none
Not Annotated 1.44 (0%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000046976 Unreliable 839.5629 839.5629 ~ 839.5629
MzDiff: none
PI(16:0/18:0) (BioDeep_00000019301)
Formula: C43H83O13P (838.5571)
3.07 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000046978 Unreliable 839.5549 839.5549 ~ 839.5549
MzDiff: none
PG(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000193835)
Formula: C46H79O11P (838.536)
3.07 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047014 Unreliable 839.5712 839.5712 ~ 839.5712
MzDiff: none
PA(24:0/PGJ2) (BioDeep_00000191305)
Formula: C47H83O10P (838.5724)
3.01 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051918 Unreliable 839.5606 839.5606 ~ 839.5606
MzDiff: none
PI(16:0/18:0) (BioDeep_00000019301)
Formula: C43H83O13P (838.5571)
2.38 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000065244 Unreliable 839.5637 839.5637 ~ 839.5637
MzDiff: none
PI(16:0/18:0) (BioDeep_00000019301)
Formula: C43H83O13P (838.5571)
1.71 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000000260 Unreliable 839.5674 839.5674 ~ 839.5674
MzDiff: none
Not Annotated 1.17 (0%) Mus musculus
[CL:0000066] epithelial cell
MSI_000056184 Unavailable 839.5667 839.5667 ~ 839.5667
MzDiff: none
PI(16:0/18:0) (BioDeep_00000019301)
Formula: C43H83O13P (838.5571)
-0.57 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 35 Sample Hits
Metabolite Species Sample
m/z_839.5674

Formula: - (n/a)
Adducts: (Ppm: 0)
Mus musculus (Urinary bladder)
HR2MSI_mouse_urinary_bladder - S096
Resolution: 10μm, 260x134

Description

Mass spectrometry imaging of phospholipids in mouse urinary bladder (imzML dataset)
The spatial distribution of phospholipids in a tissue section of mouse urinary bladder was analyzed by MALDI MS imaging at 10 micrometer pixel size with high mass resolution (using an LTQ Orbitrap mass spectrometer).

R, ö, mpp A, Guenther S, Schober Y, Schulz O, Takats Z, Kummer W, Spengler B, Histology by mass spectrometry: label-free tissue characterization obtained from high-accuracy bioanalytical imaging. Angew Chem Int Ed Engl, 49(22):3834-8(2010)

Fig. S2: Single ion images of compounds shown in Fig. 1A-B : (upper left to lower right) m/z = 743.5482 (unknown), m/z = 741.5307 (SM (16:0), [M+K]+), m/z = 798.5410 (PC (34:1), [M+K]+), m/z = 616.1767 (heme b, M+), m/z = 772.5253 (PC (32:0), [M+K]+).

Stability of determined mass values was in the range of +/- 1 ppm over 22 hours of measurement (Fig. S4), with a standard deviation of 0.56 ppm. Accuracy data were obtained during tissue scanning experiments by monitoring the mass signal at nominal mass 798. The internal lock mass function of the Orbitrap instrument was used for automatic calibration during imaging measurements, using the known matrix-related ion signals at m/z = 137.0233, m/z = 444.0925 and m/z = 716.1246.

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 2.2)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 2.9)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.2)
Homo sapiens (esophagus)
TO42T
Resolution: 17μm, 69x81

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 2.8)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (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.

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.1)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.8)
Homo sapiens (colorectal adenocarcinoma)
80TopL, 50TopR, 70BottomL, 60BottomR-profile
Resolution: 17μm, 137x136

Description

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).

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 4.5)
Homo sapiens (colorectal adenocarcinoma)
439TopL, 409TopR, 429BottomL, 419BottomR-profile
Resolution: 17μm, 157x136

Description

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).

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 4.7)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.2)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.7)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 2.8)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.3)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.4)
Homo sapiens (esophagus)
TO31T
Resolution: 75μm, 56x54

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.5)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.7)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.3)
Homo sapiens (esophagus)
LNTO30_8M_2
Resolution: 75μm, 108x68

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.2)
Homo sapiens (esophagus)
LNTO30_8M_3
Resolution: 75μm, 69x54

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.7)
Homo sapiens (esophagus)
LNTO30_8M_4
Resolution: 75μm, 62x48

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0)
Homo sapiens (esophagus)
LNTO30_8M_5
Resolution: 75μm, 56x54

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.4)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 2.4)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 2.3)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.6)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.8)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 2.1)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 1.7)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.1)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.1)
Homo sapiens (esophagus)
LNTO30_7_1
Resolution: 75μm, 69x68

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.2)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.4)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.1)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0.8)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

PI(16:0/18:0)

Formula: C43H83O13P (838.5571)
Adducts: [M+H]+ (Ppm: 0)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description