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 8 Reference Ions Near m/z 808.5447
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000043807 Reliable 808.5517 808.5511 ~ 808.5519
MzDiff: 3.4 ppm
3-O-Sulfogalactosylceramide (d18:1/18:0) (BioDeep_00000032549)
Formula: C42H81NO11S (807.553)
4.7 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000020385 Reliable 808.5516 808.5511 ~ 808.5519
MzDiff: 3.4 ppm
Solanesyl-PP (BioDeep_00000005423)
Formula: C45H76O7P2 (790.5066)
8.43 (73%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000020896 Reliable 808.5443 808.544 ~ 808.5447
MzDiff: 2.9 ppm
PI(16:0/16:1) (BioDeep_00000019300)
Formula: C41H77O13P (808.5102)
6.81 (89%) Rattus norvegicus
[UBERON:0004359] corpus epididymis
MSI_000046691 Reliable 808.5482 808.5482 ~ 808.5482
MzDiff: none
PI(16:0/16:1) (BioDeep_00000019300)
Formula: C41H77O13P (808.5102)
3.68 (100%) Mus musculus
[UBERON:0002107] liver
MSI_000057576 Unreliable 808.5502 808.5501 ~ 808.5503
MzDiff: 1.1 ppm
PE(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000186162)
Formula: C45H78NO9P (807.5414)
0.91 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000029180 Unreliable 808.5542 808.5542 ~ 808.5542
MzDiff: none
PE(18:0/20:3(6,8,11)-OH(5)) (BioDeep_00000186184)
Formula: C43H80NO9P (785.557)
1.71 (100%) Macropus giganteus
[UBERON:0002336] corpus callosum
MSI_000056209 Unavailable 808.5528 808.5528 ~ 808.5528
MzDiff: none
3-O-Sulfogalactosylceramide (d18:1/18:0) (BioDeep_00000032549)
Formula: C42H81NO11S (807.553)
-0.57 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000057413 Unreliable 808.5481 808.5481 ~ 808.5481
MzDiff: none
PI(16:0/16:1) (BioDeep_00000019300)
Formula: C41H77O13P (808.5102)
1.03 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 18 Sample Hits
Metabolite Species Sample
PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 15.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 14)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

Solanesyl-PP

Formula: C45H76O7P2 (790.5066)
Adducts: [M+NH4]+ (Ppm: 13)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_46
Resolution: 17μm, 298x106

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 13.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_47
Resolution: 17μm, 301x111

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 13.1)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_48
Resolution: 17μm, 294x107

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 13.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_04
Resolution: 17μm, 178x91

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 13.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_03
Resolution: 17μm, 159x110

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 13.6)
Rattus norvegicus (normal)
epik_dhb_head_ito01_05
Resolution: 17μm, 183x105

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 13.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_06
Resolution: 17μm, 183x103

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 13.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_14
Resolution: 17μm, 205x103

Description

PE(18:0/20:3(6,8,11)-OH(5))

Formula: C43H80NO9P (785.557)
Adducts: [M+Na]+ (Ppm: 9.8)
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(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 18.2)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

PI(16:0/16:1)

Formula: C41H77O13P (808.5102)
Adducts: [M-H2O+NH4]+ (Ppm: 18.3)
Mus musculus (Liver)
Salmonella_final_pos_recal
Resolution: 17μm, 691x430

Description

A more complete and holistic view on host–microbe interactions is needed to understand the physiological and cellular barriers that affect the efficacy of drug treatments and allow the discovery and development of new therapeutics. Here, we developed a multimodal imaging approach combining histopathology with mass spectrometry imaging (MSI) and same section imaging mass cytometry (IMC) to study the effects of Salmonella Typhimurium infection in the liver of a mouse model using the S. Typhimurium strains SL3261 and SL1344. This approach enables correlation of tissue morphology and specific cell phenotypes with molecular images of tissue metabolism. IMC revealed a marked increase in immune cell markers and localization in immune aggregates in infected tissues. A correlative computational method (network analysis) was deployed to find metabolic features associated with infection and revealed metabolic clusters of acetyl carnitines, as well as phosphatidylcholine and phosphatidylethanolamine plasmalogen species, which could be associated with pro-inflammatory immune cell types. By developing an IMC marker for the detection of Salmonella LPS, we were further able to identify and characterize those cell types which contained S. Typhimurium. [dataset] Nicole Strittmatter. Holistic Characterization of a Salmonella Typhimurium Infection Model Using Integrated Molecular Imaging, metabolights_dataset, V1; 2022. https://www.ebi.ac.uk/metabolights/MTBLS2671.

PE(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C45H78NO9P (807.5414)
Adducts: [M+H]+ (Ppm: 1.8)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

3-O-Sulfogalactosylceramide (d18:1/18:0)

Formula: C42H81NO11S (807.553)
Adducts: [M+H]+ (Ppm: 9.9)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

3-O-Sulfogalactosylceramide (d18:1/18:0)

Formula: C42H81NO11S (807.553)
Adducts: [M+H]+ (Ppm: 10.6)
Homo sapiens (esophagus)
LNTO22_2_1
Resolution: 75μm, 89x88

Description

3-O-Sulfogalactosylceramide (d18:1/18:0)

Formula: C42H81NO11S (807.553)
Adducts: [M+H]+ (Ppm: 9.7)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description

PE(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4))

Formula: C45H78NO9P (807.5414)
Adducts: [M+H]+ (Ppm: 2)
Homo sapiens (esophagus)
LNTO29_18_2
Resolution: 75μm, 62x68

Description