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 861.6569
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000001221 Unavailable 861.6656 861.6656 ~ 861.6656
MzDiff: none
TG(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) (BioDeep_00000049710)
Formula: C59H92O6 (896.6894)
-0.49 (100%) Mus musculus
[UBERON:0001224] renal pelvis
MSI_000001426 Unavailable 861.6571 861.6571 ~ 861.6571
MzDiff: none
PE(24:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000209494)
Formula: C47H90NO9P (843.6353)
-0.71 (100%) Mus musculus
[UBERON:0001224] renal pelvis
MSI_000001511 Unavailable 861.6656 861.6656 ~ 861.6656
MzDiff: none
TG(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) (BioDeep_00000049710)
Formula: C59H92O6 (896.6894)
-0.33 (100%) Mus musculus
[UBERON:0001225] cortex of kidney
MSI_000001874 Unavailable 861.6571 861.6571 ~ 861.6571
MzDiff: none
PE(24:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000209494)
Formula: C47H90NO9P (843.6353)
-0.7 (100%) Mus musculus
[UBERON:0001225] cortex of kidney
MSI_000002039 Unavailable 861.6656 861.6656 ~ 861.6656
MzDiff: none
TG(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) (BioDeep_00000049710)
Formula: C59H92O6 (896.6894)
-0.39 (100%) Mus musculus
[UBERON:0001293] outer medulla of kidney
MSI_000002341 Unavailable 861.6571 861.6571 ~ 861.6571
MzDiff: none
PE(24:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000209494)
Formula: C47H90NO9P (843.6353)
-0.7 (100%) Mus musculus
[UBERON:0001293] outer medulla of kidney
MSI_000026437 Unreliable 861.6656 861.6656 ~ 861.6656
MzDiff: none
TG(18:4(6Z,9Z,12Z,15Z)/18:3(6Z,9Z,12Z)/20:4(8Z,11Z,14Z,17Z)) (BioDeep_00000049710)
Formula: C59H92O6 (896.6894)
1.79 (100%) Mus musculus
[UBERON:0002048] lung

Found 4 Sample Hits
Metabolite Species Sample
PE(24:0/18:1(12Z)-O(9S,10R))

Formula: C47H90NO9P (843.6353)
Adducts: [M+NH4]+ (Ppm: 13.9)
Mus musculus (Kidney)
FULL_MS_centriod_CHCA_20210819
Resolution: 17μm, 638x437

Description

AP-MALDI instrument demo test, mass spectrum scan in centroid mode.

PC(20:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C50H88NO8P (861.6247)
Adducts: [M-H2O+NH4]+ (Ppm: 15.3)
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.

Isofucosterol 3-O-[6-O-(9-Octadecenoyl)-b-D-glucopyranoside]

Formula: C53H90O7 (838.6686)
Adducts: [M+Na]+ (Ppm: 1.1)
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_861.6605

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).