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 5 Reference Ions Near m/z 675.0448
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000018087 Reliable 675.0365 675.0363 ~ 675.0367
MzDiff: 1.6 ppm
Not Annotated 0.5 (0%) Vitis vinifera
[PO:0009087] mesocarp
MSI_000055243 Unreliable 675.0379 675.0379 ~ 675.0379
MzDiff: none
Not Annotated 1.49 (0%) MALDI - DHB
[NOVOCELL:BACKGROUND] blank
MSI_000017075 Unavailable 675.0448 675.0448 ~ 675.0448
MzDiff: none
1-(2-{[6-(2,3,4,6,9,11-hexachloro-5-hydroxytridec-7-en-1-yl)-5-methyl-1,3-dioxan-4-yl](hydroxy)methyl}-1,3-thiazol-4-yl)ethanone (BioDeep_00002146361)
Formula: C24H33Cl6NO5S (657.0211)
-0.33 (100%) Vitis vinifera
[PO:0009086] endocarp
MSI_000023301 Unreliable 675.0435 675.0435 ~ 675.0435
MzDiff: none
Not Annotated 1.77 (0%) Mus musculus
[UBERON:0004263] upper arm skin
MSI_000023666 Unreliable 675.0349 675.0349 ~ 675.0349
MzDiff: none
Not Annotated 1.32 (0%) Mus musculus
[UBERON:0004263] upper arm skin

Found 4 Sample Hits
Metabolite Species Sample
1-(2-{[6-(2,3,4,6,9,11-hexachloro-5-hydroxytridec-7-en-1-yl)-5-methyl-1,3-dioxan-4-yl](hydroxy)methyl}-1,3-thiazol-4-yl)ethanone

Formula: C24H33Cl6NO5S (657.0211)
Adducts: [M+NH4]+ (Ppm: 14.9)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

m/z_675.0435

Formula: - (n/a)
Adducts: (Ppm: 0)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

m/z_675.0387

Formula: - (n/a)
Adducts: (Ppm: 0)
Mus musculus (Lung)
image5
Resolution: 40μm, 163x183

Description

Supplementary Figure S8. MALDI-MSI data of mouse lung tissue administered with D9-choline and U 13C-DPPC–containing Poractant alfa surfactant (labels administered 18 h prior to sacrifice). Ion images of (a) m/z 796.6856 ([U13C-DPPC+Na]+), (b) m/z 756.5154 [PC32:0+Na]+ and (c) m/z 765.6079 ([D9-PC32:0+Na]+). (d) Overlay image of [U13C-DPPC+Na]+ (red) and [D9-PC32:0+Na]+ (green). Parts per million (ppm) mass errors are indicated in parentheses. All images were visualised using totalion-current normalisation and using hotspot removal (high quantile = 99%). DPPC = PC16:0/16:0.

m/z_675.0439

Formula: - (n/a)
Adducts: (Ppm: 0)
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%).