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 23 Reference Ions Near m/z 756.565
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043094 Reliable 756.5554 756.5552 ~ 756.5556
MzDiff: 1.4 ppm
PC(16:0/16:0) (BioDeep_00000018527)
Formula: C40H80NO8P (733.5621)
8.05 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000011452 Unreliable 756.5554 756.5554 ~ 756.5554
MzDiff: none
PC 34:3 (BioDeep_00000410746)
Formula: C42H78NO8P (755.5465)
0.21 (100%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000011459 Unreliable 756.5632 756.5632 ~ 756.5632
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
0.16 (100%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000011475 Unreliable 756.5711 756.5711 ~ 756.5711
MzDiff: none
Not Annotated 0.11 (0%) Mus musculus
[UBERON:0012378] muscle layer of urinary bladder
MSI_000047634 Unreliable 756.5586 756.5586 ~ 756.5586
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
2.2 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051877 Unreliable 756.5614 756.5614 ~ 756.5614
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
2.4 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000009825 Unavailable 756.5632 756.5632 ~ 756.5632
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
-1.74 (100%) Mus musculus
[UBERON:0004645] urinary bladder urothelium
MSI_000009828 Unavailable 756.5711 756.5711 ~ 756.5711
MzDiff: none
Not Annotated -1.75 (0%) Mus musculus
[UBERON:0004645] urinary bladder urothelium
MSI_000009833 Unavailable 756.5554 756.5554 ~ 756.5554
MzDiff: none
PC 34:3 (BioDeep_00000410746)
Formula: C42H78NO8P (755.5465)
-1.76 (100%) Mus musculus
[UBERON:0004645] urinary bladder urothelium
MSI_000021854 Unreliable 756.5591 756.5591 ~ 756.5591
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
0.59 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000043527 Unreliable 756.557 756.557 ~ 756.557
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
1.5 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000000030 Unreliable 756.5711 756.5711 ~ 756.5711
MzDiff: none
Not Annotated 2.22 (0%) Mus musculus
[CL:0000066] epithelial cell
MSI_000000034 Unreliable 756.5632 756.5632 ~ 756.5632
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
2.21 (100%) Mus musculus
[CL:0000066] epithelial cell
MSI_000000040 Unreliable 756.5554 756.5554 ~ 756.5554
MzDiff: none
PC 34:3 (BioDeep_00000410746)
Formula: C42H78NO8P (755.5465)
2.2 (100%) Mus musculus
[CL:0000066] epithelial cell
MSI_000027956 Unreliable 756.5582 756.5582 ~ 756.5582
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
1.96 (100%) Mus musculus
[UBERON:0002048] lung
MSI_000030083 Unreliable 756.5624 756.5624 ~ 756.5624
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
2.34 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000030296 Unreliable 756.5691 756.5691 ~ 756.5691
MzDiff: none
SM(d19:0/18:2(10E,12Z)+=O(9)) (BioDeep_00000215628)
Formula: C42H81N2O7P (756.5781)
1.98 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000031693 Unreliable 756.5624 756.5624 ~ 756.5624
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
0.01 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000043918 Unreliable 756.5743 756.5743 ~ 756.5743
MzDiff: none
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000018536)
Formula: C46H82NO7P (791.5829)
2.74 (100%) Rattus norvegicus
[UBERON:0002264] olfactory bulb
MSI_000043934 Unreliable 756.5587 756.5587 ~ 756.5587
MzDiff: none
SM(d16:1/20:3(8Z,11Z,14Z)-2OH(5,6)) (BioDeep_00000215268)
Formula: C41H77N2O8P (756.5417)
2.64 (100%) Rattus norvegicus
[UBERON:0002264] olfactory bulb
MSI_000061515 Unavailable 756.563 756.563 ~ 756.563
MzDiff: none
SM(d16:1/20:3(8Z,11Z,14Z)-2OH(5,6)) (BioDeep_00000215268)
Formula: C41H77N2O8P (756.5417)
-0.34 (100%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000062482 Unavailable 756.563 756.563 ~ 756.563
MzDiff: none
SM(d16:1/20:3(8Z,11Z,14Z)-2OH(5,6)) (BioDeep_00000215268)
Formula: C41H77N2O8P (756.5417)
-0.38 (100%) Mus musculus
[UBERON:0001950] neocortex
MSI_000062880 Unavailable 756.563 756.563 ~ 756.563
MzDiff: none
SM(d16:1/20:3(8Z,11Z,14Z)-2OH(5,6)) (BioDeep_00000215268)
Formula: C41H77N2O8P (756.5417)
-0.4 (100%) Mus musculus
[UBERON:0002421] hippocampal formation

Found 11 Sample Hits
Metabolite Species Sample
PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H82NO7P (791.5829)
Adducts: [M+H-2H2O]+ (Ppm: 7.7)
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.

PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H82NO7P (791.5829)
Adducts: [M+H-2H2O]+ (Ppm: 6.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_18
Resolution: 17μm, 208x104

Description

PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H82NO7P (791.5829)
Adducts: [M+H-2H2O]+ (Ppm: 6.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_04
Resolution: 17μm, 178x91

Description

PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H82NO7P (791.5829)
Adducts: [M+H-2H2O]+ (Ppm: 7.3)
Rattus norvegicus (normal)
epik_dhb_head_ito01_05
Resolution: 17μm, 183x105

Description

PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H82NO7P (791.5829)
Adducts: [M+H-2H2O]+ (Ppm: 6.9)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_06
Resolution: 17μm, 183x103

Description

PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H82NO7P (791.5829)
Adducts: [M+H-2H2O]+ (Ppm: 13.1)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C46H82NO7P (791.5829)
Adducts: [M+H-2H2O]+ (Ppm: 8.7)
Macropus giganteus (Brain)
170321_kangaroobrain-dan3-pos_maxof50.0_med1
Resolution: 50μm, 81x50

Description

Sample information Organism: Macropus giganteus (kangaroo) Organism part: Brain Condition: Wildtype Sample growth conditions: Wild

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+H]+ (Ppm: 16.8)
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).

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+H]+ (Ppm: 10.1)
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).

SM(d19:0/18:2(10E,12Z)+=O(9))

Formula: C42H81N2O7P (756.5781)
Adducts: [M]+ (Ppm: 16.6)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PC(16:0/16:0)

Formula: C40H80NO8P (733.5621)
Adducts: [M+Na]+ (Ppm: 4.8)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description