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 869.6869
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000001213 Unavailable 869.6849 869.6849 ~ 869.6849
MzDiff: none
PE(22:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000030710)
Formula: C49H90NO8P (851.6404)
-0.49 (100%) Mus musculus
[UBERON:0001224] renal pelvis
MSI_000001283 Unavailable 869.6917 869.6917 ~ 869.6917
MzDiff: none
n-(3,4-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadec-8-en-2-yl)-2-hydroxyhexacos-17-enimidic acid (BioDeep_00002085489)
Formula: C50H95NO10 (869.6956)
-0.55 (100%) Mus musculus
[UBERON:0001224] renal pelvis
MSI_000001665 Unavailable 869.6849 869.6849 ~ 869.6849
MzDiff: none
PE(22:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000030710)
Formula: C49H90NO8P (851.6404)
-0.49 (100%) Mus musculus
[UBERON:0001225] cortex of kidney
MSI_000001739 Unavailable 869.6917 869.6917 ~ 869.6917
MzDiff: none
n-(3,4-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadec-8-en-2-yl)-2-hydroxyhexacos-17-enimidic acid (BioDeep_00002085489)
Formula: C50H95NO10 (869.6956)
-0.55 (100%) Mus musculus
[UBERON:0001225] cortex of kidney
MSI_000002138 Unavailable 869.6849 869.6849 ~ 869.6849
MzDiff: none
PE(22:0/22:4(7Z,10Z,13Z,16Z)) (BioDeep_00000030710)
Formula: C49H90NO8P (851.6404)
-0.49 (100%) Mus musculus
[UBERON:0001293] outer medulla of kidney
MSI_000002203 Unavailable 869.6917 869.6917 ~ 869.6917
MzDiff: none
n-(3,4-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadec-8-en-2-yl)-2-hydroxyhexacos-17-enimidic acid (BioDeep_00002085489)
Formula: C50H95NO10 (869.6956)
-0.55 (100%) Mus musculus
[UBERON:0001293] outer medulla of kidney

Found 7 Sample Hits
Metabolite Species Sample
PE(22:0/22:4(7Z,10Z,13Z,16Z))

Formula: C49H90NO8P (851.6404)
Adducts: [M+NH4]+ (Ppm: 12.3)
Mus musculus (Kidney)
FULL_MS_centriod_CHCA_20210819
Resolution: 17μm, 638x437

Description

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

PE(22:0/22:4(7Z,10Z,13Z,16Z))

Formula: C49H90NO8P (851.6404)
Adducts: [M+NH4]+ (Ppm: 14.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_43
Resolution: 17μm, 298x106

Description

PE(22:0/22:4(7Z,10Z,13Z,16Z))

Formula: C49H90NO8P (851.6404)
Adducts: [M+NH4]+ (Ppm: 14.6)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_44
Resolution: 17μm, 299x111

Description

PE(22:0/22:4(7Z,10Z,13Z,16Z))

Formula: C49H90NO8P (851.6404)
Adducts: [M+NH4]+ (Ppm: 14.3)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito08_46
Resolution: 17μm, 298x106

Description

PE(22:0/22:4(7Z,10Z,13Z,16Z))

Formula: C49H90NO8P (851.6404)
Adducts: [M+NH4]+ (Ppm: 14.7)
Rattus norvegicus (Epididymis)
epik_dhb_head_ito03_14
Resolution: 17μm, 205x103

Description

PC(18:2(9Z,12Z)/24:0)

Formula: C50H96NO8P (869.6873)
Adducts: [M]+ (Ppm: 6)
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

PE(22:0/22:4(7Z,10Z,13Z,16Z))

Formula: C49H90NO8P (851.6404)
Adducts: [M+NH4]+ (Ppm: 18.5)
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%).