M/Z: 699.4934


Hit 2 annotations:  PA(14:1(9Z)/22:2(13Z,16Z))_[M+H]+; Enniatin A_[M+NH4]+


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 19 Reference Ions Near m/z 699.4934
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043328 Reliable 699.4985 699.4982 ~ 699.4988
MzDiff: 2.3 ppm
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
15.36 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000057867 Reliable 699.4974 699.4971 ~ 699.4978
MzDiff: 2.9 ppm
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
17.32 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000061909 Reliable 699.4842 699.4841 ~ 699.4845
MzDiff: 2.0 ppm
SM(d16:2(4E,8Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000215314)
Formula: C41H71N2O7P (734.4999)
6.17 (92%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000056868 Reliable 699.4972 699.497 ~ 699.4975
MzDiff: 2.1 ppm
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
1.15 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000026392 Unreliable 699.4876 699.4871 ~ 699.4878
MzDiff: 2.8 ppm
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
4.54 (100%) Mus musculus
[UBERON:0002048] lung
MSI_000043406 Unreliable 699.4992 699.4992 ~ 699.4993
MzDiff: 0.5 ppm
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
2.88 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047303 Unreliable 699.4948 699.4948 ~ 699.4948
MzDiff: none
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
2.42 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047347 Unreliable 699.5009 699.5009 ~ 699.5009
MzDiff: none
PE(15:0/18:3(6Z,9Z,12Z)) (BioDeep_00000030150)
Formula: C38H70NO8P (699.4839)
2.36 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047816 Unreliable 699.4885 699.4885 ~ 699.4885
MzDiff: none
Erythromycylamine (BioDeep_00000178799)
Formula: C37H70N2O12 (734.4929)
2.08 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051928 Unreliable 699.4976 699.4976 ~ 699.4976
MzDiff: none
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
2.38 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052038 Unreliable 699.4883 699.4883 ~ 699.4883
MzDiff: none
Erythromycylamine (BioDeep_00000178799)
Formula: C37H70N2O12 (734.4929)
2.34 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000058509 Unreliable 699.4843 699.4841 ~ 699.4846
MzDiff: 2.2 ppm
SM(d16:2(4E,8Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000215314)
Formula: C41H71N2O7P (734.4999)
2.94 (67%) Mus musculus
[UBERON:0001950] neocortex
MSI_000021732 Unreliable 699.4858 699.4858 ~ 699.4858
MzDiff: none
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
0.69 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000065271 Unreliable 699.4968 699.4968 ~ 699.4968
MzDiff: none
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
1.32 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000004547 Unreliable 699.4836 699.4836 ~ 699.4836
MzDiff: none
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
0.46 (100%) Homo sapiens
[UBERON:0002107] liver
MSI_000023268 Unreliable 699.4858 699.4858 ~ 699.4858
MzDiff: none
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
0.41 (100%) Mus musculus
[UBERON:0004250] upper arm bone
MSI_000056093 Unavailable 699.4993 699.4993 ~ 699.4993
MzDiff: none
PA(14:1(9Z)/22:2(13Z,16Z)) (BioDeep_00000107161)
Formula: C39H71O8P (698.4886)
-0.55 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000059866 Unavailable 699.4846 699.4846 ~ 699.4846
MzDiff: none
SM(d16:2(4E,8Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000215314)
Formula: C41H71N2O7P (734.4999)
-0.66 (100%) Mus musculus
[UBERON:0002298] brainstem
MSI_000060793 Unavailable 699.4846 699.4846 ~ 699.4846
MzDiff: none
SM(d16:2(4E,8Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000215314)
Formula: C41H71N2O7P (734.4999)
-0.49 (100%) Mus musculus
[UBERON:0002421] hippocampal formation

Found 20 Sample Hits
Metabolite Species Sample
PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 11.6)
Mus musculus (Lung)
image5
Resolution: 40μm, 163x183

Description

Supplementary 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.

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 11.6)
Mus musculus (Lung)
image2
Resolution: 40μm, 550x256

Description

Supplementary Figure S6. Ion distribution images for (a) [PC36:4+Na]+ (m/z 804.5514) and (b) [PC38:6+Na]+ (m/z 828.5515) obtained from mouse lung tissue collected 6 h after administration of D9- choline and U13C-DPPC–containing CHF5633. Parts-per-million (ppm) mass errors are indicated in parentheses. (c) Magnification of the boxed region in (a) with selected bronchiolar regions outlined in white boxes. (d) The corresponding H&E-stained tissue section with the same selected bronchiolar regions outlined in black boxes. These data demonstrate the co-localisation of the polyunsaturated lipids PC36:4 and PC38:6 with the bronchiolar regions of the lung. All MSI images were visualised using total ion current normalisation and hotspot removal (high quantile = 99%).

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 2.3)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1.1)
Homo sapiens (esophagus)
TO42T
Resolution: 17μm, 69x81

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 2.4)
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.

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1.8)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1)
Homo sapiens (esophagus)
TO39T
Resolution: 17μm, 69x81

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1.6)
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).

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1.3)
Homo sapiens (colorectal adenocarcinoma)
520TopL, 490TopR, 510BottomL, 500BottomR-profile
Resolution: 17μm, 147x131

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).

Enniatin A

Formula: C36H63N3O9 (681.4564)
Adducts: [M+NH4]+ (Ppm: 4.5)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1.7)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 0.7)
Homo sapiens (esophagus)
TO40T
Resolution: 17μm, 82x74

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 2.3)
Homo sapiens (esophagus)
LNTO30_8M_2
Resolution: 75μm, 108x68

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 2.4)
Homo sapiens (esophagus)
LNTO30_8M_5
Resolution: 75μm, 56x54

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 2.3)
Homo sapiens (esophagus)
LNTO30_7_1
Resolution: 75μm, 69x68

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 2.1)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1.6)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 2.3)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PA(14:1(9Z)/22:2(13Z,16Z))

Formula: C39H71O8P (698.4886)
Adducts: [M+H]+ (Ppm: 1.3)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description