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 2 Reference Ions Near m/z 958.5599
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000057813 Reliable 958.5687 958.5685 ~ 958.569
MzDiff: 2.0 ppm
PI(18:1(11Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) (BioDeep_00000201508)
Formula: C49H81O15P (940.5313)
3.57 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000027090 Unreliable 958.5654 958.5654 ~ 958.5654
MzDiff: none
PG(20:2(11Z,14Z)/LTE4) (BioDeep_00000194625)
Formula: C49H84NO13PS (957.5401)
1.77 (100%) Mus musculus
[UBERON:0002048] lung

Found 5 Sample Hits
Metabolite Species Sample
PIP(18:1(9Z)/18:2(9Z,12Z))

Formula: C45H82O16P2 (940.5078)
Adducts: [M+NH4]+ (Ppm: 19.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_04
Resolution: 17μm, 178x91

Description

PE(DiMe(11,3)/LTE4)

Formula: C48H81N2O12PS (940.5248)
Adducts: [M+NH4]+ (Ppm: 1.4)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_03
Resolution: 17μm, 159x110

Description

PG(20:2(11Z,14Z)/LTE4)

Formula: C49H84NO13PS (957.5401)
Adducts: [M+H]+ (Ppm: 18.8)
Mus musculus (Lung)
image4
Resolution: 40μm, 162x156

Description

Fig 6c Fig. 6 MALDI-MSI of U13C-PC16:0/16:0 acyl chain remodeling. A: Averaged MALDI mass spectrum from lung tissue collected from mice euthanized 12 h after administration of D9-choline and U13C-DPPC–containing Poractant alfa surfactant. The ion at m/z 828.6321 is assigned as the [M+Na]+ ion of 13C24-PC16:0_20:4 formed by acyl remodeling of U13C-PC16:0/16:0. The “NL” value refers to the intensity of the base peak in the full range MS1 spectrum. B: MS/MS spectrum of precursor ions at m/z 828.5 ± 0.5 with fragment ions originating from [13C24-PC16:0_20:4+Na]+ annotated. Part-per-million (ppm) mass errors are provided in parentheses. C, D: MALDI-MSI data of [U13C-DPPC+Na]+ (blue), [PC36:4+Na]+ (green) and [13C24-PC16:0_20:4+Na]+ (red) in lung tissue collected from mice (C) 12 h and (D) 18 h after label administration. All images were visualized using total-ion-current normalization and hotspot removal (high quantile = 99%). MS/MS, tandem mass spectrometry; MSI, mass spectrometry imaging; PC, phosphatidylcholine; U13C-DPPC, universally 13C-labeled dipalmitoyl PC.

PI(18:1(11Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S))

Formula: C49H81O15P (940.5313)
Adducts: [M+NH4]+ (Ppm: 3)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

PI(18:1(11Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S))

Formula: C49H81O15P (940.5313)
Adducts: [M+NH4]+ (Ppm: 4.1)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description