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 3 Reference Ions Near m/z 790.6047
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000008258 Unreliable 790.6129 790.6129 ~ 790.613
MzDiff: 0.4 ppm
DG(16:0/LTE4/0:0) (BioDeep_00000220462)
Formula: C42H73NO8S (751.5057)
6.41 (100%) Rattus norvegicus
[UBERON:0004360] cauda epididymis
MSI_000008583 Unreliable 790.6066 790.6065 ~ 790.6068
MzDiff: 1.4 ppm
PA(22:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000190602)
Formula: C43H81O9P (772.5618)
7.08 (100%) Rattus norvegicus
[UBERON:0004360] cauda epididymis
MSI_000027709 Unreliable 790.6116 790.6116 ~ 790.6116
MzDiff: none
PE(18:2(9Z,12Z)/24:1(15Z)) (BioDeep_00000030325)
Formula: C47H88NO8P (825.6247)
2.04 (100%) Mus musculus
[UBERON:0002048] lung

Found 4 Sample Hits
Metabolite Species Sample
PA(22:0/18:1(12Z)-O(9S,10R))

Formula: C43H81O9P (772.5618)
Adducts: [M+NH4]+ (Ppm: 14)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

PA(22:0/18:1(12Z)-O(9S,10R))

Formula: C43H81O9P (772.5618)
Adducts: [M+NH4]+ (Ppm: 14.1)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

PA(22:0/18:1(12Z)-O(9S,10R))

Formula: C43H81O9P (772.5618)
Adducts: [M+NH4]+ (Ppm: 11.5)
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

PE(18:2(9Z,12Z)/24:1(15Z))

Formula: C47H88NO8P (825.6247)
Adducts: [M+H-2H2O]+ (Ppm: 0.9)
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%).