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 18 Reference Ions Near m/z 816.5245
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043382 Reliable 816.5313 816.531 ~ 816.5317
MzDiff: 2.8 ppm
PE(18:0/PGE2) (BioDeep_00000186110)
Formula: C43H78NO11P (815.5312)
7.78 (62%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000043795 Reliable 816.5326 816.5324 ~ 816.533
MzDiff: 2.4 ppm
PE(18:0/PGE2) (BioDeep_00000186110)
Formula: C43H78NO11P (815.5312)
8.92 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000047059 Unreliable 816.5322 816.5322 ~ 816.5322
MzDiff: none
PE(18:0/PGE2) (BioDeep_00000186110)
Formula: C43H78NO11P (815.5312)
2.91 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047067 Unreliable 816.5245 816.5245 ~ 816.5245
MzDiff: none
Momorcharaside A (BioDeep_00000017395)
Formula: C42H72O15 (816.4871)
2.89 (100%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000047852 Unreliable 816.5165 816.5165 ~ 816.5165
MzDiff: none
Not Annotated 2.05 (0%) Homo sapiens
[UBERON:0013067] colorectal mucosa
MSI_000051849 Unreliable 816.5153 816.5153 ~ 816.5153
MzDiff: none
PS(16:0/20:4(6Z,8E,10E,14Z)-2OH(5S,12R)) (BioDeep_00000206142)
Formula: C42H74NO12P (815.4948)
2.41 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000051938 Unreliable 816.5291 816.5291 ~ 816.5291
MzDiff: none
PE(18:0/PGE2) (BioDeep_00000186110)
Formula: C43H78NO11P (815.5312)
2.38 (100%) Homo sapiens
[UBERON:0001052] rectum
MSI_000065220 Unreliable 816.531 816.531 ~ 816.531
MzDiff: none
PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:5(5Z,8Z,11Z,14Z,17Z)) (BioDeep_00000029998)
Formula: C50H78NO8P (851.5465)
1.73 (100%) Homo sapiens
[UBERON:0001155] colon
MSI_000002766 Unavailable 816.5312 816.5312 ~ 816.5312
MzDiff: none
PC(18:4(6Z,9Z,12Z,15Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000211872)
Formula: C46H74NO9P (815.5101)
-0.42 (100%) Rattus norvegicus
[UBERON:0001950] neocortex
MSI_000003558 Unavailable 816.5312 816.5312 ~ 816.5312
MzDiff: none
PC(18:4(6Z,9Z,12Z,15Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000211872)
Formula: C46H74NO9P (815.5101)
-0.6 (100%) Rattus norvegicus
[UBERON:0002037] cerebellum
MSI_000004770 Unreliable 816.5312 816.5312 ~ 816.5312
MzDiff: none
PC(18:4(6Z,9Z,12Z,15Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000211872)
Formula: C46H74NO9P (815.5101)
2.15 (100%) Rattus norvegicus
[UBERON:0002298] brainstem
MSI_000005725 Unavailable 816.5312 816.5312 ~ 816.5312
MzDiff: none
PC(18:4(6Z,9Z,12Z,15Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000211872)
Formula: C46H74NO9P (815.5101)
-0.53 (100%) Rattus norvegicus
[UBERON:0002435] striatum
MSI_000028425 Unreliable 816.5299 816.5299 ~ 816.5299
MzDiff: none
PC(18:4(6Z,9Z,12Z,15Z)/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000211872)
Formula: C46H74NO9P (815.5101)
1.17 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000029351 Unreliable 816.5219 816.5219 ~ 816.5219
MzDiff: none
Mabioside D (BioDeep_00000023768)
Formula: C42H70O14 (798.4765)
1.21 (100%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000031928 Unavailable 816.5219 816.5219 ~ 816.5219
MzDiff: none
Mabioside D (BioDeep_00000023768)
Formula: C42H70O14 (798.4765)
-0.29 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex
MSI_000044604 Unavailable 816.5287 816.5287 ~ 816.5287
MzDiff: none
PE(18:0/PGE2) (BioDeep_00000186110)
Formula: C43H78NO11P (815.5312)
-0.39 (100%) Rattus norvegicus
[UBERON:0002264] olfactory bulb
MSI_000056041 Unavailable 816.5328 816.5328 ~ 816.5328
MzDiff: none
PE(18:0/PGE2) (BioDeep_00000186110)
Formula: C43H78NO11P (815.5312)
-0.51 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000056341 Unavailable 816.5273 816.5273 ~ 816.5273
MzDiff: none
PC(14:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000210656)
Formula: C44H76NO9P (793.5257)
-0.68 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 8 Sample Hits
Metabolite Species Sample
Mabioside D

Formula: C42H70O14 (798.4765)
Adducts: [M+NH4]+ (Ppm: 14.1)
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

PA(20:1(11Z)/6 keto-PGF1alpha)

Formula: C43H77O12P (816.5152)
Adducts: [M]+ (Ppm: 8.7)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

Momorcharaside A

Formula: C42H72O15 (816.4871)
Adducts: [M-H2O+NH4]+ (Ppm: 17.3)
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).

PE(18:0/PGE2)

Formula: C43H78NO11P (815.5312)
Adducts: [M+H]+ (Ppm: 11.8)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

PC(14:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C44H76NO9P (793.5257)
Adducts: [M+Na]+ (Ppm: 15.1)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

Momorcharaside A

Formula: C42H72O15 (816.4871)
Adducts: [M-H2O+NH4]+ (Ppm: 13.4)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

PE(18:0/PGE2)

Formula: C43H78NO11P (815.5312)
Adducts: [M+H]+ (Ppm: 9.3)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PE(18:0/PGE2)

Formula: C43H78NO11P (815.5312)
Adducts: [M+H]+ (Ppm: 7.5)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description