M/Z: 726.5425


Hit 2 annotations:  PE(18:0/18:2(9Z,12Z))_[M+H-H2O]+; PG(a-13:0/i-18:0)_[M+NH4]+


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 18 Reference Ions Near m/z 726.5425
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000057877 Reliable 726.5447 726.5445 ~ 726.5449
MzDiff: 1.7 ppm
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
10.73 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043294 Reliable 726.5464 726.5461 ~ 726.5468
MzDiff: 2.6 ppm
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
6.06 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065182 Reliable 726.5446 726.5442 ~ 726.545
MzDiff: 3.2 ppm
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
5.12 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000056831 Reliable 726.5447 726.5444 ~ 726.545
MzDiff: 2.1 ppm
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
2.27 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000011454 Unreliable 726.5442 726.5442 ~ 726.5442
MzDiff: none
Not Annotated 0.19 (0%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000011465 Unreliable 726.5516 726.5516 ~ 726.5516
MzDiff: none
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
0.15 (100%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000043434 Unreliable 726.5467 726.5466 ~ 726.5468
MzDiff: 0.6 ppm
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
2.83 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047452 Unreliable 726.5481 726.5481 ~ 726.5481
MzDiff: none
1-O-beta-D-Glucopyranosyl-2,3-di-O-(8-hexadecenoyl)glycerol (BioDeep_00000025257)
Formula: C41H74O10 (726.5282)
2.28 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047520 Unreliable 726.5417 726.5417 ~ 726.5417
MzDiff: none
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
2.25 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047753 Unreliable 726.5352 726.5352 ~ 726.5352
MzDiff: none
1-O-beta-D-Glucopyranosyl-2,3-di-O-(8-hexadecenoyl)glycerol (BioDeep_00000025257)
Formula: C41H74O10 (726.5282)
2.13 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052449 Unreliable 726.535 726.535 ~ 726.535
MzDiff: none
PG(a-13:0/i-18:0) (BioDeep_00000108998)
Formula: C37H73O10P (708.4941)
2 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052464 Unreliable 726.5514 726.5514 ~ 726.5514
MzDiff: none
Not Annotated 1.98 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052524 Unreliable 726.5448 726.5448 ~ 726.5448
MzDiff: none
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
1.82 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000056728 Unreliable 726.5427 726.5425 ~ 726.5428
MzDiff: 1.3 ppm
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
2.93 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000000050 Unreliable 726.5442 726.5442 ~ 726.5442
MzDiff: none
Not Annotated 2.17 (0%) Mus musculus
[CL:0000066] epithelial cell
MSI_000000052 Unreliable 726.5516 726.5516 ~ 726.5516
MzDiff: none
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
2.17 (100%) Mus musculus
[CL:0000066] epithelial cell
MSI_000007790 726.5516 726.5516 ~ 726.5516
MzDiff: none
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
1.49 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000056091 Unavailable 726.5468 726.5468 ~ 726.5468
MzDiff: none
PE(18:0/18:2(9Z,12Z)) (BioDeep_00000019257)
Formula: C41H78NO8P (743.5465)
-0.54 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 36 Sample Hits
Metabolite Species Sample
m/z_726.5442

Formula: - (n/a)
Adducts: (Ppm: 0)
Mus musculus (Urinary bladder)
HR2MSI_mouse_urinary_bladder - S096
Resolution: 10μm, 260x134

Description

Mass spectrometry imaging of phospholipids in mouse urinary bladder (imzML dataset)
The spatial distribution of phospholipids in a tissue section of mouse urinary bladder was analyzed by MALDI MS imaging at 10 micrometer pixel size with high mass resolution (using an LTQ Orbitrap mass spectrometer).

R, ö, mpp A, Guenther S, Schober Y, Schulz O, Takats Z, Kummer W, Spengler B, Histology by mass spectrometry: label-free tissue characterization obtained from high-accuracy bioanalytical imaging. Angew Chem Int Ed Engl, 49(22):3834-8(2010)

Fig. S2: Single ion images of compounds shown in Fig. 1A-B : (upper left to lower right) m/z = 743.5482 (unknown), m/z = 741.5307 (SM (16:0), [M+K]+), m/z = 798.5410 (PC (34:1), [M+K]+), m/z = 616.1767 (heme b, M+), m/z = 772.5253 (PC (32:0), [M+K]+).

Stability of determined mass values was in the range of +/- 1 ppm over 22 hours of measurement (Fig. S4), with a standard deviation of 0.56 ppm. Accuracy data were obtained during tissue scanning experiments by monitoring the mass signal at nominal mass 798. The internal lock mass function of the Orbitrap instrument was used for automatic calibration during imaging measurements, using the known matrix-related ion signals at m/z = 137.0233, m/z = 444.0925 and m/z = 716.1246.

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.7)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 0.9)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.4)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.1)
Homo sapiens (esophagus)
TO42T
Resolution: 17μm, 69x81

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.1)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1)
Homo sapiens (esophagus)
TO39T
Resolution: 17μm, 69x81

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2)
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(18:0/18:2(9Z,12Z))

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.6)
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).

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.2)
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).

PG(a-13:0/i-18:0)

Formula: C37H73O10P (708.4941)
Adducts: [M+NH4]+ (Ppm: 17.2)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.8)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.9)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 5)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.5)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 0.5)
Homo sapiens (esophagus)
TO40T
Resolution: 17μm, 82x74

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.8)
Homo sapiens (esophagus)
TO31T
Resolution: 75μm, 56x54

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.6)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.9)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.4)
Homo sapiens (esophagus)
LNTO30_8M_2
Resolution: 75μm, 108x68

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.1)
Homo sapiens (esophagus)
LNTO30_8M_3
Resolution: 75μm, 69x54

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.6)
Homo sapiens (esophagus)
LNTO30_8M_4
Resolution: 75μm, 62x48

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.5)
Homo sapiens (esophagus)
LNTO30_8M_5
Resolution: 75μm, 56x54

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.4)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 4)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.5)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.5)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 4.1)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.7)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.8)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.4)
Homo sapiens (esophagus)
LNTO30_7_1
Resolution: 75μm, 69x68

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.2)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.7)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.5)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 1.4)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

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

Formula: C41H78NO8P (743.5465)
Adducts: [M+H-H2O]+ (Ppm: 2.2)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description