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 7 Reference Ions Near m/z 781.542
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000001100 Unavailable 781.542 781.542 ~ 781.542
MzDiff: none
PE(16:0/22:6) (BioDeep_00001987669)
Formula: C43H74NO8P (763.5152)
-0.39 (100%) Mus musculus
[UBERON:0001224] renal pelvis
MSI_000001136 Unavailable 781.548 781.548 ~ 781.548
MzDiff: none
Not Annotated -0.42 (0%) Mus musculus
[UBERON:0001224] renal pelvis
MSI_000001531 Unavailable 781.548 781.548 ~ 781.548
MzDiff: none
Not Annotated -0.37 (0%) Mus musculus
[UBERON:0001225] cortex of kidney
MSI_000001590 Unavailable 781.542 781.542 ~ 781.542
MzDiff: none
PE(16:0/22:6) (BioDeep_00001987669)
Formula: C43H74NO8P (763.5152)
-0.41 (100%) Mus musculus
[UBERON:0001225] cortex of kidney
MSI_000002032 Unavailable 781.542 781.542 ~ 781.542
MzDiff: none
PE(16:0/22:6) (BioDeep_00001987669)
Formula: C43H74NO8P (763.5152)
-0.39 (100%) Mus musculus
[UBERON:0001293] outer medulla of kidney
MSI_000002065 Unavailable 781.548 781.548 ~ 781.548
MzDiff: none
Not Annotated -0.42 (0%) Mus musculus
[UBERON:0001293] outer medulla of kidney
MSI_000031736 Unavailable 781.5484 781.5484 ~ 781.5484
MzDiff: none
PA(21:0/20:4(6E,8Z,11Z,14Z)+=O(5)) (BioDeep_00000190489)
Formula: C44H77O9P (780.5305)
-0.05 (100%) Macropus giganteus
[UBERON:0006093] precuneus cortex

Found 4 Sample Hits
Metabolite Species Sample
PE(16:0/22:6)

Formula: C43H74NO8P (763.5152)
Adducts: [M+NH4]+ (Ppm: 9)
Mus musculus (Kidney)
FULL_MS_centriod_CHCA_20210819
Resolution: 17μm, 638x437

Description

AP-MALDI instrument demo test, mass spectrum scan in centroid mode.

PA(21:0/20:4(6E,8Z,11Z,14Z)+=O(5))

Formula: C44H77O9P (780.5305)
Adducts: [M+H]+ (Ppm: 7.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito01_04
Resolution: 17μm, 178x91

Description

PE(14:0/PGF1alpha)

Formula: C39H74NO11P (763.4999)
Adducts: [M+NH4]+ (Ppm: 14.8)
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

PA(21:0/20:4(6E,8Z,11Z,14Z)+=O(5))

Formula: C44H77O9P (780.5305)
Adducts: [M+H]+ (Ppm: 11.7)
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%).