Metabolomics Toolbox

LIMS

Human Metabolome Library

HML Chemical Class Table Browse


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  ACCESSION  
  CODE  

  COMMON  
  NAME  

  CHEMICAL  
  IUPAC NAME  

  STRUCTURE  

  CHEM. FORMULA 
 -----------------------------
Molecular Weight
(Monoisotopic
and Average)
(g/mol)  

CAS Registry  
  NUMBER  

  Biofluid  
    Location    

  Shopping  
    Cart    
Acetanilides (total=1)
HMDB01859

Acetaminophen
N-(4-hydroxyphenyl)
acetamide
C8H9NO2
Mono Mass: 151.06
Avg Mass: 151.16
103-90-2

Bile
Blood
CSF
Saliva
Synovial Fluid
Urine

Acyl Glycines (total=25)
HMDB00138

Glycocholic
acid
2-[4-(3,7,
12-trihydroxy-
10,13-dimethyl-
2,3,4,5,6,
7,8,9,11,
12,14,15,
16,17-tetradecahydro-
1H-cyclopenta[
a]phenanthren-
17-yl)pentanoylamino]
acetic acid
C26H43NO6
Mono Mass: 465.31
Avg Mass: 465.62
475-31-0

Bile
Blood
Prostate Tissue
Urine

HMDB00339

2-Methylbutyrylglycine
N-(2-methyl-
1-oxobutyl)
-Glycine
C7H13NO3
Mono Mass: 159.09
Avg Mass: 159.18
52320-67-9

Urine

HMDB00439

2-Furoylglycine
2-(2-furylcarbonylamino)
acetic acid
C7H7NO4
Mono Mass: 169.04
Avg Mass: 169.13
5657-19-2

Urine

HMDB00459

3-Methylcrotonylglycine
2-(3-methylbut-
2-enoylamino)
acetic acid
C7H11NO3
Mono Mass: 157.07
Avg Mass: 157.17
33008-07-0

Urine

HMDB00532

Acetylglycine
2-acetylaminoacetic
acid
C4H7NO3
Mono Mass: 117.04
Avg Mass: 117.10
543-24-8

Blood
Urine

HMDB00590

Glutarylglycine
5-[(carboxymethyl)
amino]-5-
oxo-Pentanoic
acid
C7H11NO5
Mono Mass: 189.06
Avg Mass: 189.17
17686-38-3

Not Available

HMDB00631

Deoxycholic
acid glycine
conjugate
N-[(3a,5b,
12a)
-3,12-dihydroxy-
24-oxocholan-
24-yl]-Glycine
C26H43NO5
Mono Mass: 449.31
Avg Mass: 449.62
360-65-6

Bile
Blood
Prostate Tissue

HMDB00678

Isovalerylglycine
(3-methyl-
butyrylamino)
-acetic acid
C7H13NO3
Mono Mass: 159.09
Avg Mass: 159.18
16284-60-9

Blood
Urine

HMDB00701

Hexanoylglycine
N-(1-oxohexyl)
-glycine
C8H15NO3
Mono Mass: 173.11
Avg Mass: 173.21
24003-67-6

Urine

HMDB00714

Hippuric acid
2-benzamidoacetic
acid
C9H9NO3
Mono Mass: 179.06
Avg Mass: 179.17
495-69-2

Amniotic Fluid
Bile
Blood
CSF
Prostate Tissue
Urine

HMDB00730

Isobutyrylglycine
N-(2-methyl-
1-oxopropyl)
-glycine
C6H11NO3
Mono Mass: 145.07
Avg Mass: 145.16
15926-18-8

Urine

HMDB00735

Hydroxyphenylacetylglycine
2-[[2-(4-hydroxyphenyl)
acetyl]amino]
acetic acid
C10H11NO4
Mono Mass: 209.07
Avg Mass: 209.20
28116-23-6

Not Available

HMDB00783

Propionylglycine
N-(1-oxopropyl)
-Glycine
C5H9NO3
Mono Mass: 131.06
Avg Mass: 131.13
21709-90-0

Urine

HMDB00808

N-Butyrylglycine
2-butanoylaminoacetic
acid
C6H11NO3
Mono Mass: 145.07
Avg Mass: 145.16
20208-73-5

Urine

HMDB00821

Phenylacetylglycine
2-(2-phenylacetyl)
aminoacetic
acid
C10H11NO3
Mono Mass: 193.07
Avg Mass: 193.20
500-98-1

Blood
CSF

HMDB00832

Capryloylglycine
2-octanoylaminoacetic
acid
C10H19NO3
Mono Mass: 201.14
Avg Mass: 201.26
14246-53-8

Urine

HMDB00840

Salicyluric
acid
2-(2-hydroxybenzoyl)
aminoacetic
acid
C9H9NO4
Mono Mass: 195.05
Avg Mass: 195.17
487-54-7

Blood
Urine

HMDB00859

Methylhippuric
acid
methyl 2-benzamidoacetate
C10H11NO3
Mono Mass: 193.07
Avg Mass: 193.20
1205-08-9

Saliva
Urine

HMDB00860

Phenylpropionylglycine
2-[(3-oxo-
3-phenyl-
propyl)amino]
acetic acid
C11H13NO3
Mono Mass: 207.09
Avg Mass: 207.23
56613-60-6

Urine




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