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 3 Reference Ions Near m/z 475.061
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000053277 Unreliable 475.0633 475.0633 ~ 475.0633
MzDiff: none
Protogonyautoxin I (BioDeep_00000013203)
Formula: C10H17N7O11S2 (475.0427)
2.73 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000017583 Unreliable 475.061 475.061 ~ 475.061
MzDiff: none
3-[(2r)-5',6'-dihydroxy-5-methyl-3-oxospiro[furan-2,1'-inden]-2'-yl]-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione (BioDeep_00002133681)
Formula: C25H14O10 (474.0587)
2.04 (100%) Vitis vinifera
[PO:0009087] mesocarp
MSI_000065963 Unreliable 475.0548 475.0548 ~ 475.0548
MzDiff: none
m-Trigallic acid (BioDeep_00000026668)
Formula: C21H14O13 (474.0434)
0.97 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 5 Sample Hits
Metabolite Species Sample
Glycosmisic acid sulfate

Formula: C20H20O10S (452.0777)
Adducts: [M+Na]+ (Ppm: 11.9)
Vitis vinifera (Fruit)
grape_dhb_91_1
Resolution: 50μm, 120x114

Description

Grape berries fruit, condition: Ripe

3-[(2r)-5',6'-dihydroxy-5-methyl-3-oxospiro[furan-2,1'-inden]-2'-yl]-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione

Formula: C25H14O10 (474.0587)
Adducts: [M+H]+ (Ppm: 10.5)
Vitis vinifera (Fruit)
grape_dhb_164_1
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late

3-[(2r)-5',6'-dihydroxy-5-methyl-3-oxospiro[furan-2,1'-inden]-2'-yl]-8,9-dihydroxypyrano[4,3-c]isochromene-1,6-dione

Formula: C25H14O10 (474.0587)
Adducts: [M+H]+ (Ppm: 10)
Vitis vinifera (Fruit)
grape_dhb_163_1
Resolution: 17μm, 132x115

Description

Grape berries fruit, condition: Late

Protogonyautoxin I

Formula: C10H17N7O11S2 (475.0427)
Adducts: [M-H2O+NH4]+ (Ppm: 5.7)
Homo sapiens (colorectal adenocarcinoma)
80TopL, 50TopR, 70BottomL, 60BottomR-profile
Resolution: 17μm, 137x136

Description

The human colorectal adenocarcinoma sample was excised during a surgical operation performed at the Imperial College Healthcare NHS Trust. The sample and procedures were carried out in accordance with ethical approval (14/EE/0024).

m-Trigallic acid

Formula: C21H14O13 (474.0434)
Adducts: [M+H]+ (Ppm: 9.2)
Homo sapiens (colorectal adenocarcinoma)
120TopL, 90TopR, 110BottomL, 100BottomR-centroid
Resolution: 50μm, 132x136

Description