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 24 Reference Ions Near m/z 773.5873
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000058145 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000058309 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000058428 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000062048 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063016 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063405 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063659 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000063710 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000064799 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
8.72 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000007108 Reliable 773.5888 773.5887 ~ 773.589
MzDiff: 1.3 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
9.47 (100%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000065094 Reliable 773.5898 773.5896 ~ 773.5899
MzDiff: 1.3 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
5.87 (50%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043107 Reliable 773.5913 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
5.58 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000052486 Unreliable 773.5776 773.5776 ~ 773.5776
MzDiff: none
PA(22:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000190602)
Formula: C43H81O9P (772.5618)
1.95 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000047289 Unreliable 773.5812 773.5812 ~ 773.5812
MzDiff: none
PA(22:0/18:1(12Z)-O(9S,10R)) (BioDeep_00000190602)
Formula: C43H81O9P (772.5618)
2.43 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000052370 Unreliable 773.5848 773.5848 ~ 773.5848
MzDiff: none
PA(15:0/PGF1alpha) (BioDeep_00000188254)
Formula: C38H71O11P (734.4734)
2.13 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000047249 Unreliable 773.5885 773.5885 ~ 773.5885
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
2.49 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000057429 Unreliable 773.5897 773.5896 ~ 773.5897
MzDiff: 0.5 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
0.8 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000052229 Unreliable 773.5902 773.5902 ~ 773.5902
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
2.26 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000043684 Unreliable 773.5914 773.591 ~ 773.592
MzDiff: 3.8 ppm
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
2.65 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047275 Unreliable 773.5957 773.5957 ~ 773.5957
MzDiff: none
DG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/24:1(15Z)/0:0) (BioDeep_00000029122)
Formula: C49H82O5 (750.6162)
2.45 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000021436 Unreliable 773.5884 773.5884 ~ 773.5884
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
0.93 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000065345 Unreliable 773.5901 773.5901 ~ 773.5901
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
2.22 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000044159 Unreliable 773.5906 773.5906 ~ 773.5906
MzDiff: none
PA(20:3(5Z,8Z,11Z)/24:1(15Z)) (BioDeep_00000107499)
Formula: C47H85O8P (808.5982)
1 (100%) Rattus norvegicus
[UBERON:0002264] olfactory bulb
MSI_000056053 Unavailable 773.592 773.592 ~ 773.592
MzDiff: none
PC(16:1(9Z)/18:2(9Z,12Z)) (BioDeep_00000019215)
Formula: C42H78NO8P (755.5465)
-0.52 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 30 Sample Hits
Metabolite Species Sample
PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 10.6)
Homo sapiens (Liver)
20171107_FIT4_DHBpos_p70_s50
Resolution: 50μm, 70x70

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 10.5)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 13.7)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 9.4)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 12.9)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 15.1)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 10.6)
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).

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 6.6)
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).

PA(15:0/PGF1alpha)

Formula: C38H71O11P (734.4734)
Adducts: [M+K]+ (Ppm: 17.7)
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).

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 9)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 12.1)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 14.1)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 15.1)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 13.4)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

PE(14:0/24:1(15Z))

Formula: C43H84NO8P (773.5934)
Adducts: [M]+ (Ppm: 4)
Homo sapiens (esophagus)
TO31T
Resolution: 75μm, 56x54

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 12)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

PE(14:0/24:1(15Z))

Formula: C43H84NO8P (773.5934)
Adducts: [M]+ (Ppm: 3.8)
Homo sapiens (esophagus)
LNTO30_8M_5
Resolution: 75μm, 56x54

Description

PE(14:0/24:1(15Z))

Formula: C43H84NO8P (773.5934)
Adducts: [M]+ (Ppm: 3.6)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 14.2)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 13.6)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 13.4)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 14.5)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 14)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 12.1)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

PC(16:0/18:1(12Z)-O(9S,10R))

Formula: C42H80NO9P (773.557)
Adducts: [M-H2O+NH4]+ (Ppm: 13.2)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 12)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 12.7)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 11.6)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 12.4)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description

PC(16:1(9Z)/18:2(9Z,12Z))

Formula: C42H78NO8P (755.5465)
Adducts: [M+NH4]+ (Ppm: 10.9)
Drosophila melanogaster (brain)
Drosophila18
Resolution: 5μm, 686x685

Description

Sample information Organism: Drosophila melanogaster Organism part: Brain Condition: Healthy Sample preparation Sample stabilisation: Frozen Tissue modification: Frozen MALDI matrix: 2,5-dihydroxybenzoic acid (DHB) MALDI matrix application: TM sprayer Solvent: Aceton/water MS analysis Polarity: Positive Ionisation source: Prototype Analyzer: Orbitrap Pixel size: 5μm × 5μm Annotation settings m/z tolerance (ppm): 3 Analysis version: Original MSM Pixel count: 469910 Imzml file size: 696.23 MB Ibd file size: 814.11 MB