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 13 Reference Ions Near m/z 774.5542
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000057831 Reliable 774.5486 774.548 ~ 774.5489
MzDiff: 3.9 ppm
PC(15:0/22:6) (BioDeep_00000018526)
Formula: C45H78NO8P (791.5465)
7.47 (50%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043512 Reliable 774.5506 774.5501 ~ 774.551
MzDiff: 3.8 ppm
PS(18:0/18:0) (BioDeep_00000017592)
Formula: C42H82NO10P (791.5676)
6.83 (67%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000057840 Reliable 774.5475 774.5471 ~ 774.548
MzDiff: 3.7 ppm
PC(15:0/22:6) (BioDeep_00000018526)
Formula: C45H78NO8P (791.5465)
6.91 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043235 Unreliable 774.5456 774.5452 ~ 774.546
MzDiff: 3.3 ppm
PC(15:0/22:6) (BioDeep_00000018526)
Formula: C45H78NO8P (791.5465)
7.54 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047074 Unreliable 774.5494 774.5494 ~ 774.5494
MzDiff: none
PC(15:0/22:6) (BioDeep_00000018526)
Formula: C45H78NO8P (791.5465)
2.87 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047178 Unreliable 774.5566 774.5566 ~ 774.5566
MzDiff: none
PG(18:1(9Z)/18:1(9Z)) (BioDeep_00000019289)
Formula: C42H79O10P (774.5411)
2.62 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047746 Unreliable 774.5639 774.5639 ~ 774.5639
MzDiff: none
Not Annotated 2.14 (0%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052282 Unreliable 774.549 774.549 ~ 774.549
MzDiff: none
PC(15:0/22:6) (BioDeep_00000018526)
Formula: C45H78NO8P (791.5465)
2.22 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052374 Unreliable 774.5562 774.5562 ~ 774.5562
MzDiff: none
PG(18:1(9Z)/18:1(9Z)) (BioDeep_00000019289)
Formula: C42H79O10P (774.5411)
2.13 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000065378 Unreliable 774.5464 774.5462 ~ 774.5469
MzDiff: 2.9 ppm
PC(15:0/22:6) (BioDeep_00000018526)
Formula: C45H78NO8P (791.5465)
2.79 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000028615 Unreliable 774.546 774.546 ~ 774.546
MzDiff: none
SM(d17:2(4E,8Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000215433)
Formula: C44H75N2O7P (774.5312)
0.77 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000030863 Unreliable 774.546 774.546 ~ 774.546
MzDiff: none
SM(d17:2(4E,8Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000215433)
Formula: C44H75N2O7P (774.5312)
0.77 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000056268 Unavailable 774.5515 774.5515 ~ 774.5515
MzDiff: none
PC(16:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000210947)
Formula: C42H80NO9P (773.557)
-0.58 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 17 Sample Hits
Metabolite Species Sample
m/z_774.5463

Formula: - (n/a)
Adducts: (Ppm: 0)
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.

PG(18:1(9Z)/18:1(9Z))

Formula: C42H79O10P (774.5411)
Adducts: [M-H2O+NH4]+ (Ppm: 13.1)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

PS(18:0/18:0)

Formula: C42H82NO10P (791.5676)
Adducts: [M+H-H2O]+ (Ppm: 17.3)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

PG(18:1(9Z)/18:1(9Z))

Formula: C42H79O10P (774.5411)
Adducts: [M-H2O+NH4]+ (Ppm: 10)
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).

PG(18:1(9Z)/18:1(9Z))

Formula: C42H79O10P (774.5411)
Adducts: [M-H2O+NH4]+ (Ppm: 10.5)
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).

PS(18:0/18:0)

Formula: C42H82NO10P (791.5676)
Adducts: [M+H-H2O]+ (Ppm: 16.5)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PC(16:0/18:1(12Z)-O(9S,10R))

Formula: C42H80NO9P (773.557)
Adducts: [M+H]+ (Ppm: 17.3)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PC(16:0/18:1(12Z)-O(9S,10R))

Formula: C42H80NO9P (773.557)
Adducts: [M+H]+ (Ppm: 16.5)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

PC(16:0/18:1(12Z)-O(9S,10R))

Formula: C42H80NO9P (773.557)
Adducts: [M+H]+ (Ppm: 18.4)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

PC(15:0/22:6)

Formula: C45H78NO8P (791.5465)
Adducts: [M+H-H2O]+ (Ppm: 4.7)
Homo sapiens (esophagus)
LNTO30_8M_4
Resolution: 75μm, 62x48

Description

PC(15:0/22:6)

Formula: C45H78NO8P (791.5465)
Adducts: [M+H-H2O]+ (Ppm: 6.9)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

PS(18:0/18:0)

Formula: C42H82NO10P (791.5676)
Adducts: [M+H-H2O]+ (Ppm: 16.2)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

PS(18:0/18:0)

Formula: C42H82NO10P (791.5676)
Adducts: [M+H-H2O]+ (Ppm: 17.8)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PS(18:0/18:0)

Formula: C42H82NO10P (791.5676)
Adducts: [M+H-H2O]+ (Ppm: 17.2)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PC(15:0/22:6)

Formula: C45H78NO8P (791.5465)
Adducts: [M+H-H2O]+ (Ppm: 8.8)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

PC(15:0/22:6)

Formula: C45H78NO8P (791.5465)
Adducts: [M+H-H2O]+ (Ppm: 3.9)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

PC(15:0/22:6)

Formula: C45H78NO8P (791.5465)
Adducts: [M+H-H2O]+ (Ppm: 5.6)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description