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 19 Reference Ions Near m/z 745.5688
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000058291 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000058409 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000062029 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000062997 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063386 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063640 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063691 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000064780 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065075 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(20:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000107441)
Formula: C45H81O8P (780.5669)
8.98 (44%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000057881 Reliable 745.5604 745.56 ~ 745.5608
MzDiff: 3.4 ppm
PA(15:0/24:1(15Z)) (BioDeep_00000107188)
Formula: C42H81O8P (744.5669)
7.33 (43%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043474 Reliable 745.5598 745.5597 ~ 745.5599
MzDiff: 1.1 ppm
SM(d17:2(4E,8Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000215422)
Formula: C40H77N2O8P (744.5417)
2.32 (67%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043293 Unreliable 745.5606 745.5601 ~ 745.5608
MzDiff: 3.1 ppm
PA(15:0/24:1(15Z)) (BioDeep_00000107188)
Formula: C42H81O8P (744.5669)
3.78 (50%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047056 Unreliable 745.559 745.559 ~ 745.559
MzDiff: none
SM(d17:2(4E,8Z)/18:1(12Z)-2OH(9,10)) (BioDeep_00000215422)
Formula: C40H77N2O8P (744.5417)
2.91 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047087 Unreliable 745.5658 745.5658 ~ 745.5658
MzDiff: none
PA(15:0/24:1(15Z)) (BioDeep_00000107188)
Formula: C42H81O8P (744.5669)
2.84 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047227 Unreliable 745.5726 745.5726 ~ 745.5726
MzDiff: none
SM(d18:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000215475)
Formula: C41H81N2O7P (744.5781)
2.54 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051682 Unreliable 745.562 745.562 ~ 745.562
MzDiff: none
PA(15:0/24:1(15Z)) (BioDeep_00000107188)
Formula: C42H81O8P (744.5669)
2.65 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000051756 Unreliable 745.5688 745.5688 ~ 745.5688
MzDiff: none
Not Annotated 2.48 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000052425 Unreliable 745.5756 745.5756 ~ 745.5756
MzDiff: none
SM(d18:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000215475)
Formula: C41H81N2O7P (744.5781)
2.03 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000055936 Unavailable 745.5608 745.5608 ~ 745.5608
MzDiff: none
PC(14:0/18:3(9Z,12Z,15Z)) (BioDeep_00000019200)
Formula: C40H74NO8P (727.5152)
-0.39 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 5 Sample Hits
Metabolite Species Sample
PA(15:0/24:1(15Z))

Formula: C42H81O8P (744.5669)
Adducts: [M+H]+ (Ppm: 11.2)
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).

SM(d18:0/18:1(12Z)-O(9S,10R))

Formula: C41H81N2O7P (744.5781)
Adducts: [M+H]+ (Ppm: 17.1)
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).

PA(15:0/24:1(15Z))

Formula: C42H81O8P (744.5669)
Adducts: [M+H]+ (Ppm: 11.1)
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_745.5688

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).

PA(16:0/18:1(12Z)-2OH(9,10))

Formula: C37H71O10P (706.4785)
Adducts: [M+K]+ (Ppm: 11.4)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description