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 697.3683
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000055545 Reliable 697.3584 697.3581 ~ 697.3587
MzDiff: 2.6 ppm
Gluten exorphin B5 (BioDeep_00000053856)
Formula: C30H38N6O11 (658.2598)
13.25 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000022007 Unreliable 697.3636 697.3636 ~ 697.3636
MzDiff: none
(8S,9R,11S,13S,14S,17S)-13-Methyl-11-[4-[5-(4,4,5,5,5-pentafluoropentylsulfonyl)pentoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol (BioDeep_00000185220)
Formula: C34H43F5O5S (658.2751)
0.5 (100%) Mus musculus
[UBERON:0001499] muscle of arm
MSI_000055924 Unavailable 697.3591 697.3591 ~ 697.3591
MzDiff: none
Gluten exorphin B5 (BioDeep_00000053856)
Formula: C30H38N6O11 (658.2598)
-0.37 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 5 Sample Hits
Metabolite Species Sample
(8S,9R,11S,13S,14S,17S)-13-Methyl-11-[4-[5-(4,4,5,5,5-pentafluoropentylsulfonyl)pentoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol

Formula: C34H43F5O5S (658.2751)
Adducts: [M+K]+ (Ppm: 13.3)
Mus musculus (Left upper arm)
357_l_total ion count
Resolution: 50μm, 97x131

Description

Diseased

m/z_697.3654

Formula: - (n/a)
Adducts: (Ppm: 0)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

m/z_697.3682

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

Cenicriviroc

Formula: C41H52N4O4S (696.3709)
Adducts: [M+H]+ (Ppm: 14.2)
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).

Gluten exorphin B5

Formula: C30H38N6O11 (658.2598)
Adducts: [M+K]+ (Ppm: 1.3)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description