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 9 Reference Ions Near m/z 863.5582
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000057835 Unreliable 863.5507 863.5503 ~ 863.5509
MzDiff: 2.4 ppm
PS(18:0/PGF1alpha) (BioDeep_00000206410)
Formula: C44H82NO13P (863.5523)
4.45 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065096 Unreliable 863.5666 863.5663 ~ 863.567
MzDiff: 2.9 ppm
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
5.54 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047463 Unreliable 863.5489 863.5489 ~ 863.5489
MzDiff: none
Not Annotated 2.28 (%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052489 Unreliable 863.5538 863.5538 ~ 863.5538
MzDiff: none
PG(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000194667)
Formula: C48H79O11P (862.536)
1.95 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000047311 Unreliable 863.5566 863.5566 ~ 863.5566
MzDiff: none
PG(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000194667)
Formula: C48H79O11P (862.536)
2.4 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052465 Unreliable 863.5613 863.5613 ~ 863.5613
MzDiff: none
PE(20:3(5Z,8Z,11Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S)) (BioDeep_00000187194)
Formula: C47H76NO10P (845.5207)
1.98 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000047327 Unreliable 863.5649 863.5649 ~ 863.5649
MzDiff: none
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
2.38 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000065357 Unreliable 863.5672 863.5672 ~ 863.5672
MzDiff: none
PI(18:1/18:1) (BioDeep_00000031028)
Formula: C45H83O13P (862.5571)
2.2 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000058352 Unreliable 863.5501 863.5501 ~ 863.5501
MzDiff: none
PG(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000194667)
Formula: C48H79O11P (862.536)
1.15 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 7 Sample Hits
Metabolite Species Sample
PG(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C48H79O11P (862.536)
Adducts: [M+H]+ (Ppm: 15.5)
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).

PG(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C48H79O11P (862.536)
Adducts: [M+H]+ (Ppm: 19.5)
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).

PG(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C48H79O11P (862.536)
Adducts: [M+H]+ (Ppm: 12.2)
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).

PE(20:3(5Z,8Z,11Z)/22:6(5Z,8E,10Z,13Z,15E,19Z)-2OH(7S, 17S))

Formula: C47H76NO10P (845.5207)
Adducts: [M+NH4]+ (Ppm: 7.9)
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(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C48H79O11P (862.536)
Adducts: [M+H]+ (Ppm: 17.3)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PS(18:0/PGF1alpha)

Formula: C44H82NO13P (863.5523)
Adducts: [M]+ (Ppm: 1.4)
Homo sapiens (esophagus)
LNTO30_8M_2
Resolution: 75μm, 108x68

Description

PG(20:2(11Z,14Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C48H79O11P (862.536)
Adducts: [M+H]+ (Ppm: 5.5)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description