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 6 Reference Ions Near m/z 845.6174
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000055585 Reliable 845.6126 845.612 ~ 845.6129
MzDiff: 3.8 ppm
PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030746)
Formula: C49H84NO8P (845.5934)
4.46 (70%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047721 Unreliable 845.6101 845.6101 ~ 845.6101
MzDiff: none
SM(d20:1/6 keto-PGF1alpha) (BioDeep_00000215721)
Formula: C45H85N2O10P (844.5942)
2.15 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047873 Unreliable 845.6174 845.6174 ~ 845.6174
MzDiff: none
PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030746)
Formula: C49H84NO8P (845.5934)
2.04 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052142 Unreliable 845.6116 845.6116 ~ 845.6116
MzDiff: none
PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) (BioDeep_00000030746)
Formula: C49H84NO8P (845.5934)
2.3 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052226 Unreliable 845.6196 845.6196 ~ 845.6196
MzDiff: none
Not Annotated 2.26 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000065318 Unreliable 845.6109 845.6109 ~ 845.6109
MzDiff: none
PE(20:0/20:4(6Z,8E,10E,14Z)-2OH(5S,12R)) (BioDeep_00000186850)
Formula: C45H82NO10P (827.5676)
1.3 (100%) Homo sapiens
[UBERON:0001155] colon

Found 11 Sample Hits
Metabolite Species Sample
SM(d20:1/6 keto-PGF1alpha)

Formula: C45H85N2O10P (844.5942)
Adducts: [M+H]+ (Ppm: 14.4)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

SM(d20:1/6 keto-PGF1alpha)

Formula: C45H85N2O10P (844.5942)
Adducts: [M+H]+ (Ppm: 15.2)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C49H84NO8P (845.5934)
Adducts: [M-H2O+NH4]+ (Ppm: 0.8)
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).

m/z_845.6196

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).

PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C49H84NO8P (845.5934)
Adducts: [M-H2O+NH4]+ (Ppm: 6.2)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C49H84NO8P (845.5934)
Adducts: [M-H2O+NH4]+ (Ppm: 4.1)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C49H84NO8P (845.5934)
Adducts: [M-H2O+NH4]+ (Ppm: 3.8)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

SM(d20:1/6 keto-PGF1alpha)

Formula: C45H85N2O10P (844.5942)
Adducts: [M+H]+ (Ppm: 13.4)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

SM(d20:1/6 keto-PGF1alpha)

Formula: C45H85N2O10P (844.5942)
Adducts: [M+H]+ (Ppm: 13.9)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C49H84NO8P (845.5934)
Adducts: [M-H2O+NH4]+ (Ppm: 4.9)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PE(22:1(13Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

Formula: C49H84NO8P (845.5934)
Adducts: [M-H2O+NH4]+ (Ppm: 3.8)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description