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 416.239
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000056512 Reliable 416.2375 416.2371 ~ 416.2379
MzDiff: 3.0 ppm
(2S)-2-[[(2S)-2-Amino-3-(1H-imidazol-5-yl)propanoyl]-(2-benzamidoethyl)amino]-4-methylpentanoic acid (BioDeep_00000183256)
Formula: C21H29N5O4 (415.2219)
4.63 (56%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000055605 Reliable 416.2295 416.2295 ~ 416.2296
MzDiff: 0.5 ppm
Spironolactone (BioDeep_00000002365)
Formula: C24H32O4S (416.2021)
2.05 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000054857 Unreliable 416.248 416.248 ~ 416.248
MzDiff: none
Deoxyschizandrin (BioDeep_00000000535)
Formula: C24H32O6 (416.2199)
1.69 (100%) MALDI - DHB
[NOVOCELL:BACKGROUND] blank

Found 8 Sample Hits
Metabolite Species Sample
Deoxyschizandrin

Formula: C24H32O6 (416.2199)
Adducts: [M-H2O+NH4]+ (Ppm: 12.6)
Homo sapiens (esophagus)
LNTO22_1_3
Resolution: 75μm, 121x68

Description

Deoxyschizandrin

Formula: C24H32O6 (416.2199)
Adducts: [M-H2O+NH4]+ (Ppm: 15.7)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

(2S)-2-[[(2S)-2-Amino-3-(1H-imidazol-5-yl)propanoyl]-(2-benzamidoethyl)amino]-4-methylpentanoic acid

Formula: C21H29N5O4 (415.2219)
Adducts: [M+H]+ (Ppm: 19.7)
Homo sapiens (esophagus)
LNTO29_16_2
Resolution: 17μm, 95x101

Description

Deoxyschizandrin

Formula: C24H32O6 (416.2199)
Adducts: [M-H2O+NH4]+ (Ppm: 18.3)
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).

Deoxyschizandrin

Formula: C24H32O6 (416.2199)
Adducts: [M-H2O+NH4]+ (Ppm: 18.6)
Homo sapiens (colorectal adenocarcinoma)
439TopL, 409TopR, 429BottomL, 419BottomR-profile
Resolution: 17μm, 157x136

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).

(2S)-2-[[(2S)-2-Amino-3-(1H-imidazol-5-yl)propanoyl]-(2-benzamidoethyl)amino]-4-methylpentanoic acid

Formula: C21H29N5O4 (415.2219)
Adducts: [M+H]+ (Ppm: 18.9)
Homo sapiens (esophagus)
LNTO29_16_3
Resolution: 17μm, 108x107

Description

Deoxyschizandrin

Formula: C24H32O6 (416.2199)
Adducts: [M-H2O+NH4]+ (Ppm: 13.1)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

Deoxyschizandrin

Formula: C24H32O6 (416.2199)
Adducts: [M-H2O+NH4]+ (Ppm: 9.9)
Homo sapiens (esophagus)
LNTO22_2_2
Resolution: 75μm, 135x94

Description