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Showing metabocard for Methacrylamide (HMDB0254513)

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Record Information
Version5.0
StatusDetected but not Quantified
Creation Date2021-09-11 13:50:58 UTC
Update Date2022-11-23 22:29:16 UTC
HMDB IDHMDB0254513
Secondary Accession NumbersNone
Metabolite Identification
Common NameMethacrylamide
Descriptionmethacrylamide belongs to the class of organic compounds known as primary carboxylic acid amides. Primary carboxylic acid amides are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2. methacrylamide is an extremely weak basic (essentially neutral) compound (based on its pKa). Methacrylamide is an industrial chemical used in the production of polymers and copolymers. This compound has been identified in human blood as reported by (PMID: 31557052 ). Methacrylamide is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically Methacrylamide is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.
Structure
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MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0254513 (Methacrylamide)


  Mrv1533004181500242D          

  6  5  0  0  0  0            999 V2000
    0.8250    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0625    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
M  END
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3D MOL for HMDB0254513 (Methacrylamide)

HMDB0254513
     RDKit          3D
METHACRYLAMIDE
 13 12  0  0  0  0  0  0  0  0999 V2000
   -0.0875    0.9465   -1.0930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3601    0.1310   -0.0983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7385   -0.0600    0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7204   -0.6051    0.5301 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0725   -0.4849    0.1170 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4167   -1.3859    1.4913 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9277    1.0680   -1.4393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8408    1.5255   -1.6070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5158    0.1533   -0.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8368   -1.0703    0.8480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8697    0.6603    1.2537 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7499   -0.0522    0.7622 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3620   -0.8264   -0.8118 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  2  4  1  0
  4  5  1  0
  4  6  2  0
  1  7  1  0
  1  8  1  0
  3  9  1  0
  3 10  1  0
  3 11  1  0
  5 12  1  0
  5 13  1  0
M  END
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3D SDF for HMDB0254513 (Methacrylamide)


  Mrv1533004181500242D          

  6  5  0  0  0  0            999 V2000
    0.8250    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0625    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0254513

> <DATABASE_NAME>
hmdb

> <SMILES>
CC(=C)C(N)=O

> <INCHI_IDENTIFIER>
InChI=1S/C4H7NO/c1-3(2)4(5)6/h1H2,2H3,(H2,5,6)

> <INCHI_KEY>
FQPSGWSUVKBHSU-UHFFFAOYSA-N

> <FORMULA>
C4H7NO

> <MOLECULAR_WEIGHT>
85.106

> <EXACT_MASS>
85.052763849

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
13

> <JCHEM_AVERAGE_POLARIZABILITY>
8.780945010072147

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-methylprop-2-enamide

> <ALOGPS_LOGP>
-0.43

> <JCHEM_LOGP>
0.12155516833333338

> <ALOGPS_LOGS>
0.29

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
16.770420012368252

> <JCHEM_PKA_STRONGEST_BASIC>
-0.07692139534918818

> <JCHEM_POLAR_SURFACE_AREA>
43.09

> <JCHEM_REFRACTIVITY>
23.4707

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.68e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
methacrylamide

> <JCHEM_VEBER_RULE>
0

$$$$
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3D-SDF for HMDB0254513 (Methacrylamide)

HMDB0254513
     RDKit          3D
METHACRYLAMIDE
 13 12  0  0  0  0  0  0  0  0999 V2000
   -0.0875    0.9465   -1.0930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3601    0.1310   -0.0983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7385   -0.0600    0.4017 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7204   -0.6051    0.5301 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0725   -0.4849    0.1170 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4167   -1.3859    1.4913 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9277    1.0680   -1.4393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8408    1.5255   -1.6070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5158    0.1533   -0.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8368   -1.0703    0.8480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8697    0.6603    1.2537 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7499   -0.0522    0.7622 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3620   -0.8264   -0.8118 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  2  4  1  0
  4  5  1  0
  4  6  2  0
  1  7  1  0
  1  8  1  0
  3  9  1  0
  3 10  1  0
  3 11  1  0
  5 12  1  0
  5 13  1  0
M  END
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PDB for HMDB0254513 (Methacrylamide)

HEADER    PROTEIN                                 18-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   18-APR-15         0                                  
HETATM    1  C   UNK     0       1.540   2.667   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.310   1.334   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.850   1.334   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.540   0.000   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       2.310  -1.334   0.000  0.00  0.00           O+0
HETATM    6  N   UNK     0       0.000   0.000   0.000  0.00  0.00           N+0
CONECT    1    2                                                            
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2    5    6                                                  
CONECT    5    4                                                            
CONECT    6    4                                                            
MASTER        0    0    0    0    0    0    0    0    6    0   10    0
END
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3D PDB for HMDB0254513 (Methacrylamide)

COMPND    HMDB0254513
HETATM    1  C1  UNL     1      -0.087   0.946  -1.093  1.00  0.00           C  
HETATM    2  C2  UNL     1      -0.360   0.131  -0.098  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.738  -0.060   0.402  1.00  0.00           C  
HETATM    4  C4  UNL     1       0.720  -0.605   0.530  1.00  0.00           C  
HETATM    5  N1  UNL     1       2.072  -0.485   0.117  1.00  0.00           N  
HETATM    6  O1  UNL     1       0.417  -1.386   1.491  1.00  0.00           O  
HETATM    7  H1  UNL     1       0.928   1.068  -1.439  1.00  0.00           H  
HETATM    8  H2  UNL     1      -0.841   1.525  -1.607  1.00  0.00           H  
HETATM    9  H3  UNL     1      -2.516   0.153  -0.355  1.00  0.00           H  
HETATM   10  H4  UNL     1      -1.837  -1.070   0.848  1.00  0.00           H  
HETATM   11  H5  UNL     1      -1.870   0.660   1.254  1.00  0.00           H  
HETATM   12  H6  UNL     1       2.750  -0.052   0.762  1.00  0.00           H  
HETATM   13  H7  UNL     1       2.362  -0.826  -0.812  1.00  0.00           H  
CONECT    1    2    2    7    8
CONECT    2    3    4
CONECT    3    9   10   11
CONECT    4    5    6    6
CONECT    5   12   13
END
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SMILES for HMDB0254513 (Methacrylamide)

CC(=C)C(N)=O
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INCHI for HMDB0254513 (Methacrylamide)

InChI=1S/C4H7NO/c1-3(2)4(5)6/h1H2,2H3,(H2,5,6)
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View in JSmolView NMR AssignmentsView Stereo Labels
Synonyms
ValueSource
2-MethylacrylamideChEBI
alpha-Methyl acrylic amideChEBI
Methacrylic acid amideChEBI
Methacrylic amideChEBI
a-Methyl acrylic amideGenerator
Α-methyl acrylic amideGenerator
Methacrylate amideGenerator
Chemical FormulaC4H7NO
Average Molecular Weight85.106
Monoisotopic Molecular Weight85.052763849
IUPAC Name2-methylprop-2-enamide
Traditional Namemethacrylamide
CAS Registry NumberNot Available
SMILES
CC(=C)C(N)=O
InChI Identifier
InChI=1S/C4H7NO/c1-3(2)4(5)6/h1H2,2H3,(H2,5,6)
InChI KeyFQPSGWSUVKBHSU-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as primary carboxylic acid amides. Primary carboxylic acid amides are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2.
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassCarboxylic acid derivatives
Direct ParentPrimary carboxylic acid amides
Alternative Parents
Substituents
  • Primary carboxylic acid amide
  • Organic nitrogen compound
  • Organic oxygen compound
  • Organopnictogen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Organooxygen compound
  • Organonitrogen compound
  • Carbonyl group
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological location
ProcessNot Available
RoleNot Available
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
logP-0.43ALOGPS
logP0.12ChemAxon
logS0.29ALOGPS
pKa (Strongest Acidic)16.77ChemAxon
pKa (Strongest Basic)-0.077ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count1ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area43.09 ŲChemAxon
Rotatable Bond Count1ChemAxon
Refractivity23.47 m³·mol⁻¹ChemAxon
Polarizability8.78 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+123.46630932474
DeepCCS[M-H]-121.58830932474
DeepCCS[M-2H]-157.09430932474
DeepCCS[M+Na]+131.20130932474
AllCCS[M+H]+124.032859911
AllCCS[M+H-H2O]+119.632859911
AllCCS[M+NH4]+128.132859911
AllCCS[M+Na]+129.332859911
AllCCS[M-H]-124.032859911
AllCCS[M+Na-2H]-128.732859911
AllCCS[M+HCOO]-133.932859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
METHACRYLAMIDECC(=C)C(N)=O1862.9Standard polar33892256
METHACRYLAMIDECC(=C)C(N)=O749.8Standard non polar33892256
METHACRYLAMIDECC(=C)C(N)=O900.6Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
METHACRYLAMIDE,1TMS,isomer #1C=C(C)C(=O)N[Si](C)(C)C997.7Semi standard non polar33892256
METHACRYLAMIDE,1TMS,isomer #1C=C(C)C(=O)N[Si](C)(C)C1100.0Standard non polar33892256
METHACRYLAMIDE,1TMS,isomer #1C=C(C)C(=O)N[Si](C)(C)C1322.7Standard polar33892256
METHACRYLAMIDE,2TMS,isomer #1C=C(C)C(=O)N([Si](C)(C)C)[Si](C)(C)C1189.0Semi standard non polar33892256
METHACRYLAMIDE,2TMS,isomer #1C=C(C)C(=O)N([Si](C)(C)C)[Si](C)(C)C1145.4Standard non polar33892256
METHACRYLAMIDE,2TMS,isomer #1C=C(C)C(=O)N([Si](C)(C)C)[Si](C)(C)C1244.6Standard polar33892256
METHACRYLAMIDE,1TBDMS,isomer #1C=C(C)C(=O)N[Si](C)(C)C(C)(C)C1218.7Semi standard non polar33892256
METHACRYLAMIDE,1TBDMS,isomer #1C=C(C)C(=O)N[Si](C)(C)C(C)(C)C1261.9Standard non polar33892256
METHACRYLAMIDE,1TBDMS,isomer #1C=C(C)C(=O)N[Si](C)(C)C(C)(C)C1486.1Standard polar33892256
METHACRYLAMIDE,2TBDMS,isomer #1C=C(C)C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C1613.6Semi standard non polar33892256
METHACRYLAMIDE,2TBDMS,isomer #1C=C(C)C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C1577.0Standard non polar33892256
METHACRYLAMIDE,2TBDMS,isomer #1C=C(C)C(=O)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C1488.4Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Methacrylamide GC-MS (Non-derivatized) - 70eV, Positivesplash10-00ko-9000000000-f7f71617b62dd891e1032021-09-23Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Methacrylamide GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
MSMass Spectrum (Electron Ionization)splash10-000f-9000000000-da855b4ae7a2b404cbd82014-10-20Not AvailableView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 10V, Positive-QTOFsplash10-000i-9000000000-fc9e8cfcfa3883f409ad2016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 20V, Positive-QTOFsplash10-0006-9000000000-c2f8147c1d597060a81c2016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 40V, Positive-QTOFsplash10-00kf-9000000000-59852a5e0f1722ead8582016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 10V, Negative-QTOFsplash10-001i-9000000000-88c1c7afe6acfba295432016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 20V, Negative-QTOFsplash10-001i-9000000000-a56a61277a4ad601811e2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 40V, Negative-QTOFsplash10-0006-9000000000-eeadb5ed8a65b30dd0af2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 10V, Positive-QTOFsplash10-00ko-9000000000-66f58e891fce059aedac2021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 20V, Positive-QTOFsplash10-0006-9000000000-86f63969ff93eec3f3262021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 40V, Positive-QTOFsplash10-0006-9000000000-b2ae96797452a018841f2021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 10V, Negative-QTOFsplash10-001i-9000000000-7a143ae4298ec77ebd352021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 20V, Negative-QTOFsplash10-001i-9000000000-607cabf9d48b2dd922662021-10-12Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methacrylamide 40V, Negative-QTOFsplash10-0006-9000000000-90726b17dc36e29c52992021-10-12Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-10-25Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen Locations
  • Blood
Tissue LocationsNot Available
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodDetected but not QuantifiedNot QuantifiedNot SpecifiedNot SpecifiedNormal details
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDNot Available
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkMethacrylamide
METLIN IDNot Available
PubChem Compound6595
PDB IDNot Available
ChEBI ID51759
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]