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 17 Reference Ions Near m/z 876.5977
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000007604 Reliable 876.5917 876.5913 ~ 876.592
MzDiff: 2.9 ppm
PS(22:1(13Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000208030)
Formula: C46H86NO12P (875.5887)
3.35 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000008213 Reliable 876.5916 876.5913 ~ 876.592
MzDiff: 2.9 ppm
PS(22:1(13Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000208030)
Formula: C46H86NO12P (875.5887)
12.55 (100%) Rattus norvegicus
[UBERON:0004360] cauda epididymis
MSI_000063335 Unreliable 876.5893 876.5893 ~ 876.5893
MzDiff: none
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
0.41 (100%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000008437 Unreliable 876.6029 876.6028 ~ 876.603
MzDiff: 0.9 ppm
PC(20:1(11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000212110)
Formula: C50H86NO9P (875.604)
7.49 (100%) Rattus norvegicus
[UBERON:0004360] cauda epididymis
MSI_000060638 Unavailable 876.5892 876.589 ~ 876.5893
MzDiff: 1.1 ppm
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
-0.31 (100%) Mus musculus
[UBERON:0002421] hippocampal formation
MSI_000002979 Unavailable 876.5884 876.5884 ~ 876.5884
MzDiff: none
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
-0.75 (100%) Rattus norvegicus
[UBERON:0001950] neocortex
MSI_000003629 Unavailable 876.5884 876.5884 ~ 876.5884
MzDiff: none
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
-0.77 (100%) Rattus norvegicus
[UBERON:0002037] cerebellum
MSI_000005080 Unavailable 876.5884 876.5884 ~ 876.5884
MzDiff: none
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
-0.49 (100%) Rattus norvegicus
[UBERON:0002298] brainstem
MSI_000005560 Unreliable 876.5884 876.5884 ~ 876.5884
MzDiff: none
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
0.81 (100%) Rattus norvegicus
[UBERON:0002435] striatum
MSI_000026994 Unreliable 876.5929 876.5929 ~ 876.5929
MzDiff: none
PC(20:0/20:3(5Z,8Z,11Z)-O(14R,15S)) (BioDeep_00000211926)
Formula: C48H88NO9P (853.6196)
1.78 (100%) Mus musculus
[UBERON:0002048] lung
MSI_000028157 Unreliable 876.5977 876.5977 ~ 876.5977
MzDiff: none
PS(22:1(13Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000208030)
Formula: C46H86NO12P (875.5887)
1.83 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000028186 Unreliable 876.6067 876.6067 ~ 876.6067
MzDiff: none
PC(20:1(11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000212110)
Formula: C50H86NO9P (875.604)
1.75 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000029775 Unavailable 876.6067 876.6067 ~ 876.6067
MzDiff: none
PC(20:1(11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000212110)
Formula: C50H86NO9P (875.604)
-0.23 (100%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000031948 Unavailable 876.5977 876.5977 ~ 876.5977
MzDiff: none
PS(22:1(13Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000208030)
Formula: C46H86NO12P (875.5887)
-0.31 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000059151 Unavailable 876.5888 876.5888 ~ 876.5888
MzDiff: none
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
-0.75 (100%) Mus musculus
[UBERON:0001950] neocortex
MSI_000059540 Unreliable 876.5888 876.5888 ~ 876.5888
MzDiff: none
Dioleoylphosphatidyl-ddc (BioDeep_00000178389)
Formula: C48H84N3O10P (893.5894)
1.13 (100%) Mus musculus
[UBERON:0002298] brainstem
MSI_000061957 Unavailable 876.5921 876.5921 ~ 876.5921
MzDiff: none
PS(22:1(13Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000208030)
Formula: C46H86NO12P (875.5887)
-0.67 (100%) Mus musculus
[UBERON:0000956] cerebral cortex

Found 3 Sample Hits
Metabolite Species Sample
PC(20:0/20:3(5Z,8Z,11Z)-O(14R,15S))

Formula: C48H88NO9P (853.6196)
Adducts: [M+Na]+ (Ppm: 18.2)
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.

PC(20:1(11Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C50H86NO9P (875.604)
Adducts: [M+H]+ (Ppm: 19.8)
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%).

PS(22:1(13Z)/18:1(12Z)-2OH(9,10))

Formula: C46H86NO12P (875.5887)
Adducts: [M+H]+ (Ppm: 1.9)
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