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 14 Reference Ions Near m/z 850.5786
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000006464 Reliable 850.5753 850.575 ~ 850.5755
MzDiff: 1.9 ppm
PS(20:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000207095)
Formula: C44H84NO12P (849.5731)
8.45 (100%) Rattus norvegicus
[UBERON:0004358] caput epididymis
MSI_000009258 Unreliable 850.5739 850.5739 ~ 850.5739
MzDiff: none
PS(20:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000207095)
Formula: C44H84NO12P (849.5731)
2.16 (100%) Mus musculus
[UBERON:0004645] urinary bladder urothelium
MSI_000022046 Unreliable 850.5732 850.5732 ~ 850.5732
MzDiff: none
PS(20:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000207095)
Formula: C44H84NO12P (849.5731)
0.48 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000000231 Unreliable 850.5739 850.5739 ~ 850.5739
MzDiff: none
PS(20:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000207095)
Formula: C44H84NO12P (849.5731)
1.34 (100%) Mus musculus
[CL:0000066] epithelial cell
MSI_000023072 Unreliable 850.5732 850.5732 ~ 850.5732
MzDiff: none
PS(20:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000207095)
Formula: C44H84NO12P (849.5731)
0.63 (100%) Mus musculus
[UBERON:0004250] upper arm bone
MSI_000026516 Unreliable 850.5705 850.5705 ~ 850.5705
MzDiff: none
PS(20:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000207095)
Formula: C44H84NO12P (849.5731)
1.79 (100%) Mus musculus
[UBERON:0002048] lung
MSI_000028189 Unreliable 850.5786 850.5786 ~ 850.5786
MzDiff: none
PS(20:0/18:1(12Z)-2OH(9,10)) (BioDeep_00000207095)
Formula: C44H84NO12P (849.5731)
1.75 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000028221 Unreliable 850.5726 850.5726 ~ 850.5726
MzDiff: none
PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/19:0) (BioDeep_00000182694)
Formula: C47H80NO10P (849.552)
1.66 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000028224 Unreliable 850.5842 850.5842 ~ 850.5842
MzDiff: none
PC(18:0/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)) (BioDeep_00000211279)
Formula: C48H84NO9P (849.5883)
1.65 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000030861 Unreliable 850.5726 850.5726 ~ 850.5726
MzDiff: none
PS(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/19:0) (BioDeep_00000182694)
Formula: C47H80NO10P (849.552)
0.78 (100%) Macropus giganteus
[UBERON:0003027] cingulate cortex
MSI_000061729 Unavailable 850.5768 850.5768 ~ 850.5768
MzDiff: none
PG(18:0/PGF1alpha) (BioDeep_00000193855)
Formula: C44H83O13P (850.5571)
-0.37 (100%) Mus musculus
[UBERON:0000956] cerebral cortex
MSI_000062457 Unavailable 850.5768 850.5768 ~ 850.5768
MzDiff: none
PG(18:0/PGF1alpha) (BioDeep_00000193855)
Formula: C44H83O13P (850.5571)
-0.37 (100%) Mus musculus
[UBERON:0001950] neocortex
MSI_000062719 Unavailable 850.5768 850.5768 ~ 850.5768
MzDiff: none
PG(18:0/PGF1alpha) (BioDeep_00000193855)
Formula: C44H83O13P (850.5571)
-0.35 (100%) Mus musculus
[UBERON:0002421] hippocampal formation
MSI_000063435 Unreliable 850.5752 850.5752 ~ 850.5752
MzDiff: none
PG(18:0/PGF1alpha) (BioDeep_00000193855)
Formula: C44H83O13P (850.5571)
2.01 (100%) Mus musculus
[UBERON:0002421] hippocampal formation

Found 7 Sample Hits
Metabolite Species Sample
PS(20:0/18:1(12Z)-2OH(9,10))

Formula: C44H84NO12P (849.5731)
Adducts: [M+H]+ (Ppm: 6.5)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_18
Resolution: 17μm, 208x104

Description

PS(20:0/18:1(12Z)-2OH(9,10))

Formula: C44H84NO12P (849.5731)
Adducts: [M+H]+ (Ppm: 6.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_46
Resolution: 17μm, 298x106

Description

PS(20:0/18:1(12Z)-2OH(9,10))

Formula: C44H84NO12P (849.5731)
Adducts: [M+H]+ (Ppm: 6.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_48
Resolution: 17μm, 294x107

Description

PS(20:0/18:1(12Z)-2OH(9,10))

Formula: C44H84NO12P (849.5731)
Adducts: [M+H]+ (Ppm: 4.8)
Mus musculus (Lung)
image1
Resolution: 40μm, 187x165

Description

Fig. 2 MALDI-MSI data from the same mouse lung tissue analyzed in Fig. 1. A: Optical image of the post-MSI, H&E-stained tissue section. B–D, F–G: Ion images of (B) m/z 796.6855 ([U13C-DPPC+Na]+), (C) m/z 756.5514 ([PC32:0+Na]+), (D) m/z 765.6079 ([D9-PC32:0+Na]+), (F) m/z 754.5359 ([PC32:1+Na]+), and (G) m/z 763.5923 ([D9-PC32:1+Na]+). E, H: Ratio images of (E) [D9-PC32:0+Na]+:[PC32:0+Na]+ and (H) [D9-PC32:1+Na]+:[PC32:1+Na]+. Part-per-million (ppm) mass errors are indicated in parentheses. All images were visualized using total-ion-current normalization and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0. U13C-DPPC, universally 13C-labeled dipalmitoyl PC; PC, phosphatidylcholine; MSI, mass spectrometry imaging; H&E, hematoxylin and eosin. Fig 1-3, Fig S1-S3, S5

PS(20:0/18:1(12Z)-2OH(9,10))

Formula: C44H84NO12P (849.5731)
Adducts: [M+H]+ (Ppm: 4.1)
Mus musculus (Lung)
image2
Resolution: 40μm, 550x256

Description

Supplementary Figure S6. Ion distribution images for (a) [PC36:4+Na]+ (m/z 804.5514) and (b) [PC38:6+Na]+ (m/z 828.5515) obtained from mouse lung tissue collected 6 h after administration of D9- choline and U13C-DPPC–containing CHF5633. Parts-per-million (ppm) mass errors are indicated in parentheses. (c) Magnification of the boxed region in (a) with selected bronchiolar regions outlined in white boxes. (d) The corresponding H&E-stained tissue section with the same selected bronchiolar regions outlined in black boxes. These data demonstrate the co-localisation of the polyunsaturated lipids PC36:4 and PC38:6 with the bronchiolar regions of the lung. All MSI images were visualised using total ion current normalisation and hotspot removal (high quantile = 99%).

PS(20:0/18:1(12Z)-2OH(9,10))

Formula: C44H84NO12P (849.5731)
Adducts: [M+H]+ (Ppm: 2.1)
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

PG(18:0/PGF1alpha)

Formula: C44H83O13P (850.5571)
Adducts: [M-H2O+NH4]+ (Ppm: 4.2)
Mus musculus (brain)
Brain01_Bregma1-42_02_centroid
Resolution: 17μm, 434x258

Description