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 15 Reference Ions Near m/z 817.5347
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000055501 Reliable 817.5355 817.5353 ~ 817.5356
MzDiff: 1.5 ppm
PI(16:0/18:2) (BioDeep_00000019302)
Formula: C43H79O13P (834.5258)
5.63 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047608 Unreliable 817.5337 817.5337 ~ 817.5337
MzDiff: none
PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000190830)
Formula: C47H77O9P (816.5305)
2.21 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047797 Unreliable 817.527 817.527 ~ 817.527
MzDiff: none
Not Annotated 2.1 (0%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051742 Unreliable 817.5293 817.5293 ~ 817.5293
MzDiff: none
Not Annotated 2.5 (0%) Homo sapiens
[UBERON:0001052] rectum
MSI_000051761 Unreliable 817.5355 817.5355 ~ 817.5355
MzDiff: none
PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000190830)
Formula: C47H77O9P (816.5305)
2.48 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000065355 Unreliable 817.5347 817.5347 ~ 817.5349
MzDiff: 0.9 ppm
PI(16:0/18:2) (BioDeep_00000019302)
Formula: C43H79O13P (834.5258)
2.79 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000002981 Unavailable 817.5334 817.5334 ~ 817.5334
MzDiff: none
PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000190830)
Formula: C47H77O9P (816.5305)
-0.75 (100%) Rattus norvegicus
[UBERON:0001950] neocortex
MSI_000003624 Unavailable 817.5334 817.5334 ~ 817.5334
MzDiff: none
PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000190830)
Formula: C47H77O9P (816.5305)
-0.75 (100%) Rattus norvegicus
[UBERON:0002037] cerebellum
MSI_000004903 Unreliable 817.5334 817.5334 ~ 817.5334
MzDiff: none
PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000190830)
Formula: C47H77O9P (816.5305)
0.5 (100%) Rattus norvegicus
[UBERON:0002298] brainstem
MSI_000005480 Unreliable 817.5334 817.5334 ~ 817.5334
MzDiff: none
PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000190830)
Formula: C47H77O9P (816.5305)
2.17 (100%) Rattus norvegicus
[UBERON:0002435] striatum
MSI_000029317 Unreliable 817.5363 817.5363 ~ 817.5363
MzDiff: none
PS(16:0/20:3(5Z,8Z,11Z)-O(14R,15S)) (BioDeep_00000206102)
Formula: C42H74NO11P (799.4999)
1.3 (100%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000030016 Unavailable 817.5293 817.5293 ~ 817.5293
MzDiff: none
Not Annotated -0.41 (0%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000031758 Unavailable 817.5293 817.5293 ~ 817.5293
MzDiff: none
Not Annotated -0.1 (0%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000044690 Unavailable 817.532 817.532 ~ 817.532
MzDiff: none
PI(16:0/18:2) (BioDeep_00000019302)
Formula: C43H79O13P (834.5258)
-0.42 (100%) Rattus norvegicus
[UBERON:0002264] olfactory bulb
MSI_000055984 Unavailable 817.5366 817.5366 ~ 817.5366
MzDiff: none
PI(16:0/18:2) (BioDeep_00000019302)
Formula: C43H79O13P (834.5258)
-0.46 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 24 Sample Hits
Metabolite Species Sample
PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C47H77O9P (816.5305)
Adducts: [M+H]+ (Ppm: 5.3)
Rattus norvegicus (Brain)
Spectroswiss - sol_2x_br_2
Resolution: 17μm, 488x193

Description

m/z_817.5293

Formula: - (n/a)
Adducts: (Ppm: 0)
Macropus giganteus (Brain)
170321_kangaroobrain-dan3-pos_maxof50.0_med1
Resolution: 50μm, 81x50

Description

Sample information Organism: Macropus giganteus (kangaroo) Organism part: Brain Condition: Wildtype Sample growth conditions: Wild

PS(16:0/20:3(5Z,8Z,11Z)-O(14R,15S))

Formula: C42H74NO11P (799.4999)
Adducts: [M+NH4]+ (Ppm: 3.1)
Macropus giganteus (Brain)
170321_kangaroobrain-dan3-pos_maxof50.0_med1
Resolution: 50μm, 81x50

Description

Sample information Organism: Macropus giganteus (kangaroo) Organism part: Brain Condition: Wildtype Sample growth conditions: Wild

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 15.2)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 12.6)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 17.8)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

PA(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C47H77O9P (816.5305)
Adducts: [M+H]+ (Ppm: 5)
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(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C47H77O9P (816.5305)
Adducts: [M+H]+ (Ppm: 6.7)
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(22:2(13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C47H77O9P (816.5305)
Adducts: [M+H]+ (Ppm: 2.8)
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).

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 16.7)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 17.2)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 16.6)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 16.7)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 15.6)
Homo sapiens (esophagus)
TO41T
Resolution: 75μm, 69x43

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 17.4)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 16.9)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 16)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 15.9)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 15.8)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 16.6)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 15.2)
Homo sapiens (colorectal adenocarcinoma)
240TopL, 210TopR, 230BottomL, 220BottomR-centroid
Resolution: 50μm, 142x141

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 16)
Homo sapiens (colorectal adenocarcinoma)
200TopL, 170TopR, 190BottomL, 180BottomR-centroid
Resolution: 50μm, 132x126

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 14.9)
Homo sapiens (colorectal adenocarcinoma)
160TopL,130TopR,150BottomL,140BottomR-centroid
Resolution: 50μm, 142x136

Description

PI(16:0/18:2)

Formula: C43H79O13P (834.5258)
Adducts: [M+H-H2O]+ (Ppm: 15.8)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description