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 970.6103
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000020307 Reliable 970.6194 970.6191 ~ 970.6199
MzDiff: 3.3 ppm
PGP(i-22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000200916)
Formula: C48H90O14P2 (952.5806)
10.09 (100%) Rattus norvegicus
[UBERON:0004358] caput epididymis
MSI_000065051 Reliable 970.6146 970.6142 ~ 970.6148
MzDiff: 2.8 ppm
PGP(i-22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000200916)
Formula: C48H90O14P2 (952.5806)
4.3 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000056413 Reliable 970.6128 970.6125 ~ 970.6129
MzDiff: 1.8 ppm
PGP(i-22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000200916)
Formula: C48H90O14P2 (952.5806)
4.32 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000047637 Unreliable 970.6151 970.6151 ~ 970.6151
MzDiff: none
PGP(i-22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000200916)
Formula: C48H90O14P2 (952.5806)
2.2 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047846 Unreliable 970.605 970.605 ~ 970.605
MzDiff: none
PI(18:0/6 keto-PGF1alpha) (BioDeep_00000201364)
Formula: C47H85O17P (952.5524)
2.06 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000050003 Unreliable 970.616 970.616 ~ 970.616
MzDiff: none
PGP(i-22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000200916)
Formula: C48H90O14P2 (952.5806)
1.22 (100%) Mytilus edulis
[UBERON:0009120] gill filament
MSI_000050993 Unreliable 970.616 970.616 ~ 970.616
MzDiff: none
PGP(i-22:0/20:3(6,8,11)-OH(5)) (BioDeep_00000200916)
Formula: C48H90O14P2 (952.5806)
0.38 (100%) Mytilus edulis
[UBERON:2001856] gill ray

Found 23 Sample Hits
Metabolite Species Sample
PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.4)
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.

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 4.2)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.4)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1.9)
Homo sapiens (esophagus)
TO42T
Resolution: 17μm, 69x81

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.9)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 3.5)
Homo sapiens (esophagus)
TO39T
Resolution: 17μm, 69x81

Description

PI(18:0/6 keto-PGF1alpha)

Formula: C47H85O17P (952.5524)
Adducts: [M+NH4]+ (Ppm: 19.3)
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).

PI(18:0/6 keto-PGF1alpha)

Formula: C47H85O17P (952.5524)
Adducts: [M+NH4]+ (Ppm: 19.3)
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).

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1.1)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 3.9)
Homo sapiens (esophagus)
TO40T
Resolution: 17μm, 82x74

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1)
Homo sapiens (esophagus)
TO31T
Resolution: 75μm, 56x54

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.8)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1.6)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.9)
Homo sapiens (esophagus)
LNTO30_8M_5
Resolution: 75μm, 56x54

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.5)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.4)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.7)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 0.9)
Homo sapiens (esophagus)
LNTO30_7_1
Resolution: 75μm, 69x68

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1.6)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PGP(i-22:0/20:3(6,8,11)-OH(5))

Formula: C48H90O14P2 (952.5806)
Adducts: [M+NH4]+ (Ppm: 1.5)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

m/z_970.6104

Formula: - (n/a)
Adducts: (Ppm: 0)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description