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 25 Reference Ions Near m/z 814.5257
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000055533 Reliable 814.5275 814.5271 ~ 814.5276
MzDiff: 2.0 ppm
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
9.18 (64%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000061238 Reliable 814.5357 814.5353 ~ 814.5358
MzDiff: 1.9 ppm
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
6.65 (100%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000020504 Reliable 814.5352 814.5351 ~ 814.5355
MzDiff: 1.8 ppm
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
4.77 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000020852 Reliable 814.5347 814.5346 ~ 814.5348
MzDiff: 0.8 ppm
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
5.45 (100%) Rattus norvegicus
[UBERON:0004358] caput epididymis
MSI_000046490 Reliable 814.5303 814.5303 ~ 814.5303
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
4.41 (100%) Mus musculus
[UBERON:0002107] liver
MSI_000058747 Unreliable 814.5355 814.5353 ~ 814.5358
MzDiff: 1.9 ppm
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
1.49 (100%) Mus musculus
[UBERON:0001950] neocortex
MSI_000056887 Unreliable 814.5255 814.5253 ~ 814.5257
MzDiff: 1.9 ppm
PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)) (BioDeep_00000186156)
Formula: C43H76NO11P (813.5156)
2.71 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000001199 Unavailable 814.5297 814.5297 ~ 814.5297
MzDiff: none
PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)) (BioDeep_00000186156)
Formula: C43H76NO11P (813.5156)
-0.47 (100%) Mus musculus
[UBERON:0001224] renal pelvis
MSI_000001782 Unavailable 814.5297 814.5297 ~ 814.5297
MzDiff: none
PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)) (BioDeep_00000186156)
Formula: C43H76NO11P (813.5156)
-0.59 (100%) Mus musculus
[UBERON:0001225] cortex of kidney
MSI_000002147 Unavailable 814.5297 814.5297 ~ 814.5297
MzDiff: none
PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15)) (BioDeep_00000186156)
Formula: C43H76NO11P (813.5156)
-0.5 (100%) Mus musculus
[UBERON:0001293] outer medulla of kidney
MSI_000028461 Unreliable 814.5161 814.5161 ~ 814.5161
MzDiff: none
PA(12:0/LTE4) (BioDeep_00000187776)
Formula: C38H66NO11PS (775.4094)
1.07 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000028544 Unreliable 814.5235 814.5235 ~ 814.5235
MzDiff: none
Not Annotated 0.92 (0%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000028956 Unreliable 814.5325 814.5325 ~ 814.5325
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
0.13 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000030430 Unreliable 814.5325 814.5325 ~ 814.5325
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
1.78 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000030662 Unreliable 814.5235 814.5235 ~ 814.5235
MzDiff: none
Not Annotated 1.3 (0%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000030782 Unreliable 814.5161 814.5161 ~ 814.5161
MzDiff: none
PA(12:0/LTE4) (BioDeep_00000187776)
Formula: C38H66NO11PS (775.4094)
1 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000031291 Unreliable 814.5325 814.5325 ~ 814.5325
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
1.41 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000031697 Unreliable 814.5235 814.5235 ~ 814.5235
MzDiff: none
Not Annotated 0.01 (0%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000031861 Unavailable 814.5161 814.5161 ~ 814.5161
MzDiff: none
PA(12:0/LTE4) (BioDeep_00000187776)
Formula: C38H66NO11PS (775.4094)
-0.23 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000050046 Unreliable 814.5172 814.5172 ~ 814.5172
MzDiff: none
MART-1 Antigen (BioDeep_00000177272)
Formula: C37H67N9O11 (813.496)
1.06 (100%) Mytilus edulis
[UBERON:0009120] gill filament
MSI_000050051 Unreliable 814.5352 814.5352 ~ 814.5352
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
1.05 (100%) Mytilus edulis
[UBERON:0009120] gill filament
MSI_000050670 Unreliable 814.5352 814.5352 ~ 814.5352
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
1.41 (100%) Mytilus edulis
[UBERON:2001856] gill ray
MSI_000056116 Unavailable 814.5276 814.5276 ~ 814.5276
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
-0.55 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000060129 Unavailable 814.5353 814.5353 ~ 814.5353
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
-1.02 (100%) Mus musculus
[UBERON:0002298] brainstem
MSI_000060392 Unreliable 814.5353 814.5353 ~ 814.5353
MzDiff: none
PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030583)
Formula: C47H76NO8P (813.5308)
0.04 (100%) Mus musculus
[UBERON:0002421] hippocampal formation

Found 17 Sample Hits
Metabolite Species Sample
PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15))

Formula: C43H76NO11P (813.5156)
Adducts: [M+H]+ (Ppm: 8.4)
Mus musculus (Kidney)
FULL_MS_centriod_CHCA_20210819
Resolution: 17μm, 638x437

Description

AP-MALDI instrument demo test, mass spectrum scan in centroid mode.

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 3.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 3.8)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_14
Resolution: 17μm, 205x103

Description

m/z_814.5235

Formula: - (n/a)
Adducts: (Ppm: 0)
Macropus giganteus (Brain)
170321_kangaroobrain-dan3-pos_maxof50.0_med1
Resolution: 50μm, 81x50

Description

Sample information Organism: Macropus giganteus (kangaroo) Organism part: Brain Condition: Wildtype Sample growth conditions: Wild

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 12.9)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15))

Formula: C43H76NO11P (813.5156)
Adducts: [M+H]+ (Ppm: 5.8)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 9.6)
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.

PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15))

Formula: C43H76NO11P (813.5156)
Adducts: [M+H]+ (Ppm: 3)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15))

Formula: C43H76NO11P (813.5156)
Adducts: [M+H]+ (Ppm: 5.3)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 12.9)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 15.7)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15))

Formula: C43H76NO11P (813.5156)
Adducts: [M+H]+ (Ppm: 7.2)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 13.5)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PE(18:1(11Z)/6 keto-PGF1alpha)

Formula: C43H78NO12P (831.5261)
Adducts: [M+H-H2O]+ (Ppm: 6.4)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PE(20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C47H76NO8P (813.5308)
Adducts: [M+H]+ (Ppm: 13)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15))

Formula: C43H76NO11P (813.5156)
Adducts: [M+H]+ (Ppm: 5.7)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

PE(18:0/20:5(7Z,9Z,11E,13E,17Z)-3OH(5,6,15))

Formula: C43H76NO11P (813.5156)
Adducts: [M+H]+ (Ppm: 3.5)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description