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 9 Reference Ions Near m/z 179.0366
NovoCell ID m/z Mass Window Metabolite Ranking Anatomy Context
MSI_000052737 Reliable 179.0346 179.0343 ~ 179.0349
MzDiff: 2.4 ppm
2,3-Dihydroxy-5-methylthio-4-pentenoic acid (BioDeep_00000169780)
Formula: C6H10O4S (178.03)
11.82 (100%) DESI
[NOVOCELL:BACKGROUND] blank
MSI_000017326 Reliable 179.0314 179.0314 ~ 179.0314
MzDiff: 0.1 ppm
Aesculetin (BioDeep_00000000120)
Formula: C9H6O4 (178.0266)
2.86 (100%) Vitis vinifera
[PO:0009087] mesocarp
MSI_000043663 Unreliable 179.046 179.046 ~ 179.046
MzDiff: none
Cysteinylglycine (BioDeep_00000001313)
Formula: C5H10N2O3S (178.0412)
1.37 (100%) Homo sapiens
[UBERON:0001043] esophagus
MSI_000016526 Unreliable 179.0314 179.0314 ~ 179.0314
MzDiff: 0.1 ppm
Aesculetin (BioDeep_00000000120)
Formula: C9H6O4 (178.0266)
0.66 (100%) Vitis vinifera
[PO:0009086] endocarp
MSI_000029016 Unreliable 179.0424 179.0424 ~ 179.0424
MzDiff: none
Amifostine (BioDeep_00000003434)
Formula: C5H15N2O3PS (214.0541)
0.03 (100%) Macropus giganteus
[UBERON:0001891] midbrain
MSI_000035458 Unreliable 179.033 179.033 ~ 179.033
MzDiff: none
Aesculetin (BioDeep_00000000120)
Formula: C9H6O4 (178.0266)
0.1 (100%) Posidonia oceanica
[PO:0006203] pericycle
MSI_000039775 Unreliable 179.0314 179.0314 ~ 179.0314
MzDiff: none
Aesculetin (BioDeep_00000000120)
Formula: C9H6O4 (178.0266)
1.56 (100%) Posidonia oceanica
[PO:0005417] phloem
MSI_000055768 Unreliable 179.0355 179.0355 ~ 179.0355
MzDiff: none
2,3-Dihydroxy-5-methylthio-4-pentenoic acid (BioDeep_00000169780)
Formula: C6H10O4S (178.03)
0.28 (100%) Homo sapiens
[UBERON:0007779] transudate
MSI_000057657 Unreliable 179.0457 179.0457 ~ 179.0457
MzDiff: none
Cysteinylglycine (BioDeep_00000001313)
Formula: C5H10N2O3S (178.0412)
0.71 (100%) Homo sapiens
[UBERON:0007779] transudate

Found 16 Sample Hits
Metabolite Species Sample
Aesculetin

Formula: C9H6O4 (178.0266)
Adducts: [M+H]+ (Ppm: 1.6)
Posidonia oceanica (root)
20190613_MS1_A19r-18
Resolution: 17μm, 246x264

Description

Aesculetin

Formula: C9H6O4 (178.0266)
Adducts: [M+H]+ (Ppm: 13.9)
Posidonia oceanica (root)
MS1_20180404_PO_1200
Resolution: 17μm, 193x208

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 15.9)
Homo sapiens (esophagus)
LNTO22_1_4
Resolution: 17μm, 82x80

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 14.3)
Homo sapiens (esophagus)
TO42T
Resolution: 17μm, 69x81

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 8.1)
Homo sapiens (esophagus)
LNTO22_1_9
Resolution: 75μm, 89x74

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 14.8)
Homo sapiens (esophagus)
LNTO26_7_1
Resolution: 17μm, 75x74

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 9.8)
Homo sapiens (esophagus)
LNTO26_7_2
Resolution: 17μm, 135x101

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 14.8)
Homo sapiens (esophagus)
LNTO26_7_3
Resolution: 75μm, 82x88

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 16.5)
Homo sapiens (esophagus)
TO40T
Resolution: 17μm, 82x74

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 15.9)
Homo sapiens (esophagus)
TO31T
Resolution: 75μm, 56x54

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 14.3)
Homo sapiens (esophagus)
TO29T
Resolution: 75μm, 56x48

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 3.7)
Homo sapiens (esophagus)
LNTO22_1_5
Resolution: 75μm, 135x94

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 13.7)
Homo sapiens (esophagus)
LNTO22_1_7
Resolution: 75μm, 69x54

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 9.2)
Homo sapiens (esophagus)
LNTO22_1_8
Resolution: 75μm, 69x61

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 14.8)
Homo sapiens (esophagus)
LNTO26_16_1
Resolution: 75μm, 95x88

Description

2,3-Dihydroxy-5-methylthio-4-pentenoic acid

Formula: C6H10O4S (178.03)
Adducts: [M+H]+ (Ppm: 13.2)
Homo sapiens (esophagus)
LNTO30_7_2
Resolution: 75μm, 82x68

Description