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 857.516
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043134 Reliable 857.5203 857.5201 ~ 857.5209
MzDiff: 3.4 ppm
Chlorophyll a (BioDeep_00000004162)
Formula: C55H72MgN4O5 (892.5353)
12.13 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043268 Reliable 857.5196 857.519 ~ 857.5198
MzDiff: 3.5 ppm
Chlorophyll a (BioDeep_00000004162)
Formula: C55H72MgN4O5 (892.5353)
8.97 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047110 Unreliable 857.5206 857.5206 ~ 857.5206
MzDiff: none
Chlorophyll a (BioDeep_00000004162)
Formula: C55H72MgN4O5 (892.5353)
2.79 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047116 Unreliable 857.512 857.512 ~ 857.512
MzDiff: none
PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000195468)
Formula: C48H73O11P (856.489)
2.77 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051691 Unreliable 857.5181 857.5181 ~ 857.5181
MzDiff: none
Chlorophyll a (BioDeep_00000004162)
Formula: C55H72MgN4O5 (892.5353)
2.61 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000051696 Unreliable 857.5094 857.5094 ~ 857.5094
MzDiff: none
PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000195468)
Formula: C48H73O11P (856.489)
2.6 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000057409 Unreliable 857.5187 857.5184 ~ 857.5189
MzDiff: 2.2 ppm
Chlorophyll a (BioDeep_00000004162)
Formula: C55H72MgN4O5 (892.5353)
0.78 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000065385 Unreliable 857.519 857.519 ~ 857.519
MzDiff: none
Chlorophyll a (BioDeep_00000004162)
Formula: C55H72MgN4O5 (892.5353)
2.39 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000056139 Unavailable 857.5209 857.5209 ~ 857.5209
MzDiff: none
Chlorophyll a (BioDeep_00000004162)
Formula: C55H72MgN4O5 (892.5353)
-0.56 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 33 Sample Hits
Metabolite Species Sample
PGP(18:0/18:1(11Z))

Formula: C42H82O13P2 (856.523)
Adducts: [M+H]+ (Ppm: 16.7)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 4.1)
Homo sapiens (esophagus)
TO42T
Resolution: 17μm, 69x81

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.2)
Homo sapiens (esophagus)
LNTO30_8M_1
Resolution: 17μm, 69x54

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 4.1)
Homo sapiens (esophagus)
TO39T
Resolution: 17μm, 69x81

Description

PG(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:4(6E,8Z,11Z,14Z)+=O(5))

Formula: C48H73O11P (856.489)
Adducts: [M+H]+ (Ppm: 18.3)
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).

PGP(18:0/18:1(11Z))

Formula: C42H82O13P2 (856.523)
Adducts: [M+H]+ (Ppm: 12.1)
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).

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.9)
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).

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 4)
Homo sapiens (NA)
160TopL,130TopR,150BottomL,140BottomR-profile
Resolution: 17μm, 142x136

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.5)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 1.6)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 0.6)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 1.9)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 5.8)
Homo sapiens (esophagus)
TO40T
Resolution: 17μm, 82x74

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.5)
Homo sapiens (esophagus)
TO31T
Resolution: 75μm, 56x54

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 1.6)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.3)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3)
Homo sapiens (esophagus)
LNTO30_8M_2
Resolution: 75μm, 108x68

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.1)
Homo sapiens (esophagus)
LNTO30_8M_3
Resolution: 75μm, 69x54

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 2.4)
Homo sapiens (esophagus)
LNTO30_8M_4
Resolution: 75μm, 62x48

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 2.6)
Homo sapiens (esophagus)
LNTO30_8M_5
Resolution: 75μm, 56x54

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 2.8)
Homo sapiens (esophagus)
LNTO30_17_2
Resolution: 75μm, 82x54

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 1.9)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 1.9)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 1.2)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 1.6)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.5)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 2.8)
Homo sapiens (esophagus)
LNTO30_7_1
Resolution: 75μm, 69x68

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.1)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.5)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 2.8)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3.8)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

Chlorophyll a

Formula: C55H72MgN4O5 (892.5353)
Adducts: [M+H-2H2O]+ (Ppm: 3)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description