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 4 Reference Ions Near m/z 826.4759
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000006502 Reliable 826.4759 826.4759 ~ 826.476
MzDiff: 0.2 ppm
Collagen (BioDeep_00000228024)
Formula: C36H60N10O11 (808.4443)
5.5 (100%) Rattus norvegicus
[UBERON:0004358] caput epididymis
MSI_000051678 Unreliable 826.4814 826.4814 ~ 826.4814
MzDiff: none
Not Annotated 2.66 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000021414 Unreliable 826.4849 826.4849 ~ 826.4849
MzDiff: none
Calenduloside G methyl ester (BioDeep_00000023846)
Formula: C43H68O14 (808.4609)
0.96 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000021579 Unreliable 826.4771 826.4771 ~ 826.4771
MzDiff: none
PS(DiMe(9,3)/MonoMe(11,3)) (BioDeep_00000054735)
Formula: C43H72NO12P (825.4792)
0.81 (100%) Mus musculus
[UBERON:0001499] muscle of arm

Found 11 Sample Hits
Metabolite Species Sample
Collagen

Formula: C36H60N10O11 (808.4443)
Adducts: [M+NH4]+ (Ppm: 2.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

Collagen

Formula: C36H60N10O11 (808.4443)
Adducts: [M+NH4]+ (Ppm: 2.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

PS(DiMe(9,3)/MonoMe(11,3))

Formula: C43H72NO12P (825.4792)
Adducts: [M+H]+ (Ppm: 11.3)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

PS(DiMe(9,3)/MonoMe(11,3))

Formula: C43H72NO12P (825.4792)
Adducts: [M+H]+ (Ppm: 18.3)
Mus musculus (Lung)
image3
Resolution: 40μm, 146x190

Description

Fig. 4 MALDI-MSI data of mouse lung tissue after administration with D9-choline and U13C-DPPC–containing Poractant alfa surfactant (labels administered 12 h prior to tissue collection). 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-PC32:0+Na]+ (red) and [D9-PC32:0+Na]+ (green). 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. MSI, mass spectrometry imaging; PC, phosphatidylcholine; U13C-DPPC, universally 13C-labeled dipalmitoyl PC.

PS(DiMe(9,3)/MonoMe(11,3))

Formula: C43H72NO12P (825.4792)
Adducts: [M+H]+ (Ppm: 13.6)
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.

Collagen

Formula: C36H60N10O11 (808.4443)
Adducts: [M+NH4]+ (Ppm: 6.5)
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%).

Collagen

Formula: C36H60N10O11 (808.4443)
Adducts: [M+NH4]+ (Ppm: 3.9)
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).

Collagen

Formula: C36H60N10O11 (808.4443)
Adducts: [M+NH4]+ (Ppm: 0.2)
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).

Phytolaccoside E

Formula: C42H66O16 (826.4351)
Adducts: [M-H2O+NH4]+ (Ppm: 18.8)
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).

Collagen

Formula: C36H60N10O11 (808.4443)
Adducts: [M+NH4]+ (Ppm: 1.3)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

Collagen

Formula: C36H60N10O11 (808.4443)
Adducts: [M+NH4]+ (Ppm: 5.6)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description