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 7 Reference Ions Near m/z 817.5992
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000006624 Reliable 817.5935 817.5933 ~ 817.5939
MzDiff: 2.4 ppm
PA(24:1(15Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000191431)
Formula: C45H85O10P (816.588)
6.64 (100%) Rattus norvegicus
[UBERON:0004358] caput epididymis
MSI_000021202 Reliable 817.5936 817.5933 ~ 817.5939
MzDiff: 2.4 ppm
PA(24:1(15Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000191431)
Formula: C45H85O10P (816.588)
3.2 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000047736 Unreliable 817.5897 817.5897 ~ 817.5897
MzDiff: none
Not Annotated 2.14 (0%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052356 Unreliable 817.593 817.593 ~ 817.593
MzDiff: none
Not Annotated 2.15 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052592 Unreliable 817.5992 817.5992 ~ 817.5992
MzDiff: none
Not Annotated 1.43 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052968 Unreliable 817.6062 817.6062 ~ 817.6062
MzDiff: none
SM(d19:0/PGF2alpha) (BioDeep_00000215618)
Formula: C44H85N2O9P (816.5992)
3.11 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000026766 Unreliable 817.5942 817.5942 ~ 817.5942
MzDiff: none
PA(24:1(15Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000191431)
Formula: C45H85O10P (816.588)
1.79 (100%) Mus musculus
[UBERON:0002048] lung

Found 5 Sample Hits
Metabolite Species Sample
PA(24:1(15Z)/18:1(12Z)-2OH(9,10))

Formula: C45H85O10P (816.588)
Adducts: [M+H]+ (Ppm: 1.9)
Mus musculus (Lung)
image1
Resolution: 40μm, 187x165

Description

Fig. 2 MALDI-MSI data from the same mouse lung tissue analyzed in Fig. 1. A: Optical image of the post-MSI, H&E-stained tissue section. B–D, F–G: Ion images of (B) m/z 796.6855 ([U13C-DPPC+Na]+), (C) m/z 756.5514 ([PC32:0+Na]+), (D) m/z 765.6079 ([D9-PC32:0+Na]+), (F) m/z 754.5359 ([PC32:1+Na]+), and (G) m/z 763.5923 ([D9-PC32:1+Na]+). E, H: Ratio images of (E) [D9-PC32:0+Na]+:[PC32:0+Na]+ and (H) [D9-PC32:1+Na]+:[PC32:1+Na]+. Part-per-million (ppm) mass errors are indicated in parentheses. All images were visualized using total-ion-current normalization and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0. U13C-DPPC, universally 13C-labeled dipalmitoyl PC; PC, phosphatidylcholine; MSI, mass spectrometry imaging; H&E, hematoxylin and eosin. Fig 1-3, Fig S1-S3, S5

PA(24:1(15Z)/18:1(12Z)-2OH(9,10))

Formula: C45H85O10P (816.588)
Adducts: [M+H]+ (Ppm: 1.3)
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.

m/z_817.5974

Formula: - (n/a)
Adducts: (Ppm: 0)
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).

m/z_817.5992

Formula: - (n/a)
Adducts: (Ppm: 0)
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).

SM(d19:0/PGF2alpha)

Formula: C44H85N2O9P (816.5992)
Adducts: [M+H]+ (Ppm: 5.4)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description