M/Z: 702.5462


Hit 2 annotations:  PE(P-16:0/18:1(9Z))_[M+H]+; Trodusquemine_[M+NH4]+


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 702.5462
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043173 Reliable 702.5456 702.5452 ~ 702.5459
MzDiff: 3.0 ppm
PE(P-16:0/18:1(9Z)) (BioDeep_00000031943)
Formula: C39H76NO7P (701.5359)
11.09 (88%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043820 Reliable 702.5376 702.5372 ~ 702.5379
MzDiff: 2.6 ppm
PE(P-16:0/18:1(9Z)) (BioDeep_00000031943)
Formula: C39H76NO7P (701.5359)
6.14 (15%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043233 Reliable 702.5365 702.5361 ~ 702.5369
MzDiff: 3.3 ppm
Not Annotated 6.8 (0%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000065219 Reliable 702.5363 702.536 ~ 702.5367
MzDiff: 2.5 ppm
Not Annotated 4.67 (0%) Homo sapiens
[UBERON:0001155] colon
MSI_000043272 Unreliable 702.5435 702.5432 ~ 702.5438
MzDiff: 2.3 ppm
PE(P-16:0/18:1(9Z)) (BioDeep_00000031943)
Formula: C39H76NO7P (701.5359)
5.33 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047664 Unreliable 702.5413 702.5413 ~ 702.5413
MzDiff: none
Not Annotated 2.18 (0%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047702 Unreliable 702.5471 702.5471 ~ 702.5471
MzDiff: none
PE(P-16:0/18:1(9Z)) (BioDeep_00000031943)
Formula: C39H76NO7P (701.5359)
2.16 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000065363 Unreliable 702.5442 702.5442 ~ 702.5442
MzDiff: none
PE(P-16:0/18:1(9Z)) (BioDeep_00000031943)
Formula: C39H76NO7P (701.5359)
2.55 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000056141 Unavailable 702.5464 702.5464 ~ 702.5464
MzDiff: none
PE(P-16:0/18:1(9Z)) (BioDeep_00000031943)
Formula: C39H76NO7P (701.5359)
-0.56 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 28 Sample Hits
Metabolite Species Sample
PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 3.4)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 0)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

Trodusquemine

Formula: C37H72N4O5S (684.5223)
Adducts: [M+NH4]+ (Ppm: 14.6)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.6)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 5.6)
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).

Trodusquemine

Formula: C37H72N4O5S (684.5223)
Adducts: [M+NH4]+ (Ppm: 11.6)
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).

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.6)
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(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.1)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 0.9)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 3.3)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 4.6)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 2.9)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 2.9)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 0.6)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.2)
Homo sapiens (esophagus)
LNTO30_8M_3
Resolution: 75μm, 69x54

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.7)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 4.3)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 3.4)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 2.9)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.7)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 3.9)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 3.4)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.6)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.7)
Homo sapiens (esophagus)
LNTO30_7_1
Resolution: 75μm, 69x68

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 0.9)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1.4)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 0.7)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

PE(P-16:0/18:1(9Z))

Formula: C39H76NO7P (701.5359)
Adducts: [M+H]+ (Ppm: 1)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description