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 6 Reference Ions Near m/z 654.1011
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000010363 Unavailable 654.0951 654.0951 ~ 654.0952
MzDiff: 0.0 ppm
Lonafarnib (BioDeep_00000229516)
Formula: C27H31Br2ClN4O2 (636.0502)
-0.99 (100%) Bathymodiolus
[UBERON:0009120] gill filament
MSI_000012176 Unavailable 654.0951 654.0951 ~ 654.0952
MzDiff: 0.0 ppm
Lonafarnib (BioDeep_00000229516)
Formula: C27H31Br2ClN4O2 (636.0502)
-0.98 (100%) Bathymodiolus
[UBERON:2000211] gill lamella
MSI_000054924 Unreliable 654.0964 654.0964 ~ 654.0964
MzDiff: none
Lonafarnib (BioDeep_00000229516)
Formula: C27H31Br2ClN4O2 (636.0502)
1.64 (100%) MALDI - DHB
[NOVOCELL:BACKGROUND] blank
MSI_000004326 Unreliable 654.0995 654.0995 ~ 654.0995
MzDiff: none
Cytidylyl-(5'-3')-5'-inosinic acid homopolymer (BioDeep_00000182527)
Formula: C19H25N7O15P2 (653.0884)
0.76 (100%) Homo sapiens
[UBERON:0002107] liver
MSI_000010180 Unavailable 654.0969 654.0969 ~ 654.0969
MzDiff: none
Lonafarnib (BioDeep_00000229516)
Formula: C27H31Br2ClN4O2 (636.0502)
-0.49 (100%) Bathymodiolus
[UBERON:0009120] gill filament
MSI_000027456 Unreliable 654.0962 654.0962 ~ 654.0962
MzDiff: none
Lonafarnib (BioDeep_00000229516)
Formula: C27H31Br2ClN4O2 (636.0502)
1.99 (100%) Mus musculus
[UBERON:0000913] interstitial fluid

Found 8 Sample Hits
Metabolite Species Sample
Lonafarnib

Formula: C27H31Br2ClN4O2 (636.0502)
Adducts: [M+NH4]+ (Ppm: 16.9)
Bathymodiolus (epithelial host cells)
MPIMM_054_QE_P_BP_CF_Bputeoserpentis_MALDI-FISH8_Sl16_s1_DHB_233x233_3um
Resolution: 3μm, 233x233

Description

Lonafarnib

Formula: C27H31Br2ClN4O2 (636.0502)
Adducts: [M+NH4]+ (Ppm: 19.7)
Bathymodiolus (epithelial host cells)
MPIMM_039_QE_P_BP_CF_Bputeoserpentis_MALDI-FISH8_Sl14_s1_DHB_233x233_3um
Resolution: 3μm, 233x234

Description

Cytidylyl-(5'-3')-5'-inosinic acid homopolymer

Formula: C19H25N7O15P2 (653.0884)
Adducts: [M+H]+ (Ppm: 5.9)
Homo sapiens (Liver)
20171107_FIT4_DHBpos_p70_s50
Resolution: 50μm, 70x70

Description

Cytidylyl-(5'-3')-5'-inosinic acid homopolymer

Formula: C19H25N7O15P2 (653.0884)
Adducts: [M+H]+ (Ppm: 4)
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

Lonafarnib

Formula: C27H31Br2ClN4O2 (636.0502)
Adducts: [M+NH4]+ (Ppm: 18.6)
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%).

{8-[(2r,3s)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydro-1-benzopyran-3-yl]-2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl}oxidanesulfonic acid

Formula: C30H20O14S (636.0574)
Adducts: [M+NH4]+ (Ppm: 15.1)
Posidonia oceanica (root)
20190613_MS1_A19r-18
Resolution: 17μm, 246x264

Description

Lonafarnib

Formula: C27H31Br2ClN4O2 (636.0502)
Adducts: [M+NH4]+ (Ppm: 18.9)
Mytilus edulis (mantle)
20190201_MS38_Crassostrea_Mantle_350-1500_DHB_pos_A28_10um_270x210
Resolution: 10μm, 270x210

Description

m/z_654.0985

Formula: - (n/a)
Adducts: (Ppm: 0)
Drosophila melanogaster (brain)
Drosophila18
Resolution: 5μm, 686x685

Description

Sample information Organism: Drosophila melanogaster Organism part: Brain Condition: Healthy Sample preparation Sample stabilisation: Frozen Tissue modification: Frozen MALDI matrix: 2,5-dihydroxybenzoic acid (DHB) MALDI matrix application: TM sprayer Solvent: Aceton/water MS analysis Polarity: Positive Ionisation source: Prototype Analyzer: Orbitrap Pixel size: 5μm × 5μm Annotation settings m/z tolerance (ppm): 3 Analysis version: Original MSM Pixel count: 469910 Imzml file size: 696.23 MB Ibd file size: 814.11 MB