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 21 Reference Ions Near m/z 716.5197
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000058096 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000058296 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000058416 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000062036 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063004 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063393 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063647 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063698 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000064787 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.1 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
12.56 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043305 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.0 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
9.19 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065082 Reliable 716.5237 716.5231 ~ 716.524
MzDiff: 3.4 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
10.64 (73%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043100 Reliable 716.5254 716.5251 ~ 716.5259
MzDiff: 3.0 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
5.62 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047144 Unreliable 716.5261 716.5261 ~ 716.5261
MzDiff: none
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
2.71 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047179 Unreliable 716.5197 716.5197 ~ 716.5197
MzDiff: none
Tildipirosin (BioDeep_00000184431)
Formula: C41H71N3O8 (733.5241)
2.62 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047273 Unreliable 716.51 716.51 ~ 716.51
MzDiff: none
PC(14:0/20:5(5Z,8Z,11Z,14Z,17Z)) (BioDeep_00000019202)
Formula: C42H74NO8P (751.5152)
2.45 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051673 Unreliable 716.5226 716.5226 ~ 716.5226
MzDiff: none
PE(16:0/18:2(9Z,12Z)) (BioDeep_00000018638)
Formula: C39H74NO8P (715.5152)
2.68 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000051674 Unreliable 716.529 716.529 ~ 716.529
MzDiff: none
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
2.68 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000051798 Unreliable 716.5162 716.5162 ~ 716.5162
MzDiff: none
Not Annotated 2.44 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000057375 Unreliable 716.5237 716.5237 ~ 716.5238
MzDiff: 0.2 ppm
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
0.92 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000065386 Unreliable 716.5241 716.5241 ~ 716.5241
MzDiff: none
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
2.34 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000056005 Unavailable 716.5259 716.5259 ~ 716.5259
MzDiff: none
PE(P-18:0/20:4(5Z,8Z,11Z,14Z)) (BioDeep_00000028156)
Formula: C43H78NO7P (751.5516)
-0.48 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 17 Sample Hits
Metabolite Species Sample
PE(16:0/18:2(9Z,12Z))

Formula: C39H74NO8P (715.5152)
Adducts: [M+H]+ (Ppm: 0.2)
Homo sapiens (Liver)
20171107_FIT4_DHBpos_p70_s50
Resolution: 50μm, 70x70

Description

PE(16:0/18:2(9Z,12Z))

Formula: C39H74NO8P (715.5152)
Adducts: [M+H]+ (Ppm: 1.2)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

PE(16:0/18:2(9Z,12Z))

Formula: C39H74NO8P (715.5152)
Adducts: [M+H]+ (Ppm: 0.9)
Homo sapiens (esophagus)
TO42T
Resolution: 17μm, 69x81

Description

PE(P-18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C43H78NO7P (751.5516)
Adducts: [M+H-2H2O]+ (Ppm: 19.3)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

PE(16:0/18:2(9Z,12Z))

Formula: C39H74NO8P (715.5152)
Adducts: [M+H]+ (Ppm: 1)
Homo sapiens (esophagus)
TO39T
Resolution: 17μm, 69x81

Description

Tildipirosin

Formula: C41H71N3O8 (733.5241)
Adducts: [M+H-H2O]+ (Ppm: 1.5)
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).

PE(16:0/18:2(9Z,12Z))

Formula: C39H74NO8P (715.5152)
Adducts: [M+H]+ (Ppm: 0.9)
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).

m/z_716.5162

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).

m/z_716.5182

Formula: - (n/a)
Adducts: (Ppm: 0)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PE(P-18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C43H78NO7P (751.5516)
Adducts: [M+H-2H2O]+ (Ppm: 19.5)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PE(16:0/18:2(9Z,12Z))

Formula: C39H74NO8P (715.5152)
Adducts: [M+H]+ (Ppm: 0.5)
Homo sapiens (esophagus)
TO40T
Resolution: 17μm, 82x74

Description

PE(P-18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C43H78NO7P (751.5516)
Adducts: [M+H-2H2O]+ (Ppm: 19.3)
Homo sapiens (esophagus)
LNTO30_8M_3
Resolution: 75μm, 69x54

Description

PE(P-18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C43H78NO7P (751.5516)
Adducts: [M+H-2H2O]+ (Ppm: 18.7)
Homo sapiens (esophagus)
LNTO30_8M_4
Resolution: 75μm, 62x48

Description

PE(P-18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C43H78NO7P (751.5516)
Adducts: [M+H-2H2O]+ (Ppm: 19.7)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PE(P-18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C43H78NO7P (751.5516)
Adducts: [M+H-2H2O]+ (Ppm: 19)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PE(P-18:0/20:4(5Z,8Z,11Z,14Z))

Formula: C43H78NO7P (751.5516)
Adducts: [M+H-2H2O]+ (Ppm: 20)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

PE(16:0/18:2(9Z,12Z))

Formula: C39H74NO8P (715.5152)
Adducts: [M+H]+ (Ppm: 0.2)
Drosophila melanogaster (brain)
Drosophila18
Resolution: 5μm, 686x685

Description

Sample information Organism: Drosophila melanogaster Organism part: Brain Condition: Healthy Sample preparation Sample stabilisation: Frozen Tissue modification: Frozen MALDI matrix: 2,5-dihydroxybenzoic acid (DHB) MALDI matrix application: TM sprayer Solvent: Aceton/water MS analysis Polarity: Positive Ionisation source: Prototype Analyzer: Orbitrap Pixel size: 5μm × 5μm Annotation settings m/z tolerance (ppm): 3 Analysis version: Original MSM Pixel count: 469910 Imzml file size: 696.23 MB Ibd file size: 814.11 MB