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Showing metabocard for Methyl hexyl ether (HMDB0032407)

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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 17:49:39 UTC
Update Date2023-02-21 17:22:05 UTC
HMDB IDHMDB0032407
Secondary Accession Numbers
  • HMDB32407
Metabolite Identification
Common NameMethyl hexyl ether
DescriptionMethyl hexyl ether, also known as 1-methoxy-hexane or hexyl methyl ether, belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups. Based on a literature review very few articles have been published on Methyl hexyl ether.
Structure
Data?1677000125
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0032407 (Methyl hexyl ether)


  Mrv0541 05061306302D          

  8  7  0  0  0  0            999 V2000
    1.0461    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0474    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7605    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9039    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6184    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  2  1  0  0  0  0
  8  7  1  0  0  0  0
M  END
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3D MOL for HMDB0032407 (Methyl hexyl ether)

HMDB0032407
     RDKit          3D
Methyl hexyl ether
 24 23  0  0  0  0  0  0  0  0999 V2000
    3.2861   -0.4783    0.4678 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1055   -0.0883   -0.4177 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0935    0.6637    0.4228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1053    1.0916   -0.3597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8625   -0.0432   -0.9711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3843   -1.0233    0.0335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2397   -0.4675    0.9438 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3834    0.1084    0.4159 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9115   -1.2539   -0.0326 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9479    0.3748    0.6775 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8606   -0.8886    1.4144 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4869    0.6083   -1.1875 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6969   -1.0283   -0.8409 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6167    1.5994    0.7572 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8188    0.1137    1.3340 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2439    1.7405   -1.2129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7251    1.7450    0.2733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1379   -0.6006   -1.6118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6878    0.3487   -1.5977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5538   -1.5043    0.5899 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9249   -1.8521   -0.4740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0125   -0.6017   -0.1492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9833    0.4941    1.2930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0678    0.9419   -0.2410 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  5 18  1  0
  5 19  1  0
  6 20  1  0
  6 21  1  0
  8 22  1  0
  8 23  1  0
  8 24  1  0
M  END
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3D SDF for HMDB0032407 (Methyl hexyl ether)


  Mrv0541 05061306302D          

  8  7  0  0  0  0            999 V2000
    1.0461    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0474    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7605    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9039    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6184    1.8414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  2  1  0  0  0  0
  8  7  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0032407

> <DATABASE_NAME>
hmdb

> <SMILES>
CCCCCCOC

> <INCHI_IDENTIFIER>
InChI=1S/C7H16O/c1-3-4-5-6-7-8-2/h3-7H2,1-2H3

> <INCHI_KEY>
ICBJCVRQDSQPGI-UHFFFAOYSA-N

> <FORMULA>
C7H16O

> <MOLECULAR_WEIGHT>
116.2013

> <EXACT_MASS>
116.120115134

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
15.41556085768742

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
1-methoxyhexane

> <ALOGPS_LOGP>
2.76

> <JCHEM_LOGP>
2.3375857796666666

> <ALOGPS_LOGS>
-2.15

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-4.100778739698077

> <JCHEM_POLAR_SURFACE_AREA>
9.23

> <JCHEM_REFRACTIVITY>
36.088100000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
8.14e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
hexane, 1-methoxy-

> <JCHEM_VEBER_RULE>
1

$$$$
Download

3D-SDF for HMDB0032407 (Methyl hexyl ether)

HMDB0032407
     RDKit          3D
Methyl hexyl ether
 24 23  0  0  0  0  0  0  0  0999 V2000
    3.2861   -0.4783    0.4678 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1055   -0.0883   -0.4177 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0935    0.6637    0.4228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1053    1.0916   -0.3597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8625   -0.0432   -0.9711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3843   -1.0233    0.0335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2397   -0.4675    0.9438 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3834    0.1084    0.4159 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9115   -1.2539   -0.0326 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9479    0.3748    0.6775 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8606   -0.8886    1.4144 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4869    0.6083   -1.1875 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6969   -1.0283   -0.8409 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6167    1.5994    0.7572 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8188    0.1137    1.3340 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2439    1.7405   -1.2129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7251    1.7450    0.2733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1379   -0.6006   -1.6118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6878    0.3487   -1.5977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5538   -1.5043    0.5899 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9249   -1.8521   -0.4740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0125   -0.6017   -0.1492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9833    0.4941    1.2930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0678    0.9419   -0.2410 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  4 16  1  0
  4 17  1  0
  5 18  1  0
  5 19  1  0
  6 20  1  0
  6 21  1  0
  8 22  1  0
  8 23  1  0
  8 24  1  0
M  END
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PDB for HMDB0032407 (Methyl hexyl ether)

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0       1.953   2.667   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      11.288   3.437   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       3.286   3.437   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       4.620   2.667   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       5.954   3.437   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       7.287   2.667   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       8.621   3.437   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       9.955   2.667   0.000  0.00  0.00           O+0
CONECT    1    3                                                            
CONECT    2    8                                                            
CONECT    3    1    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8                                                       
CONECT    8    2    7                                                       
MASTER        0    0    0    0    0    0    0    0    8    0   14    0
END
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3D PDB for HMDB0032407 (Methyl hexyl ether)

COMPND    HMDB0032407
HETATM    1  C1  UNL     1       3.286  -0.478   0.468  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.106  -0.088  -0.418  1.00  0.00           C  
HETATM    3  C3  UNL     1       1.093   0.664   0.423  1.00  0.00           C  
HETATM    4  C4  UNL     1      -0.105   1.092  -0.360  1.00  0.00           C  
HETATM    5  C5  UNL     1      -0.862  -0.043  -0.971  1.00  0.00           C  
HETATM    6  C6  UNL     1      -1.384  -1.023   0.033  1.00  0.00           C  
HETATM    7  O1  UNL     1      -2.240  -0.468   0.944  1.00  0.00           O  
HETATM    8  C7  UNL     1      -3.383   0.108   0.416  1.00  0.00           C  
HETATM    9  H1  UNL     1       3.911  -1.254  -0.033  1.00  0.00           H  
HETATM   10  H2  UNL     1       3.948   0.375   0.677  1.00  0.00           H  
HETATM   11  H3  UNL     1       2.861  -0.889   1.414  1.00  0.00           H  
HETATM   12  H4  UNL     1       2.487   0.608  -1.188  1.00  0.00           H  
HETATM   13  H5  UNL     1       1.697  -1.028  -0.841  1.00  0.00           H  
HETATM   14  H6  UNL     1       1.617   1.599   0.757  1.00  0.00           H  
HETATM   15  H7  UNL     1       0.819   0.114   1.334  1.00  0.00           H  
HETATM   16  H8  UNL     1       0.244   1.740  -1.213  1.00  0.00           H  
HETATM   17  H9  UNL     1      -0.725   1.745   0.273  1.00  0.00           H  
HETATM   18  H10 UNL     1      -0.138  -0.601  -1.612  1.00  0.00           H  
HETATM   19  H11 UNL     1      -1.688   0.349  -1.598  1.00  0.00           H  
HETATM   20  H12 UNL     1      -0.554  -1.504   0.590  1.00  0.00           H  
HETATM   21  H13 UNL     1      -1.925  -1.852  -0.474  1.00  0.00           H  
HETATM   22  H14 UNL     1      -4.012  -0.602  -0.149  1.00  0.00           H  
HETATM   23  H15 UNL     1      -3.983   0.494   1.293  1.00  0.00           H  
HETATM   24  H16 UNL     1      -3.068   0.942  -0.241  1.00  0.00           H  
CONECT    1    2    9   10   11
CONECT    2    3   12   13
CONECT    3    4   14   15
CONECT    4    5   16   17
CONECT    5    6   18   19
CONECT    6    7   20   21
CONECT    7    8
CONECT    8   22   23   24
END
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SMILES for HMDB0032407 (Methyl hexyl ether)

CCCCCCOC
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INCHI for HMDB0032407 (Methyl hexyl ether)

InChI=1S/C7H16O/c1-3-4-5-6-7-8-2/h3-7H2,1-2H3
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View in JSmolView Stereo Labels
Synonyms
ValueSource
1-Methoxy-hexaneHMDB
1-MethoxyhexaneHMDB
Ether, hexyl methylHMDB
Hexyl methyl etherHMDB
Methyl-N-hexyl etherHMDB
Methyl hexyl etherMeSH
Chemical FormulaC7H16O
Average Molecular Weight116.2013
Monoisotopic Molecular Weight116.120115134
IUPAC Name1-methoxyhexane
Traditional Namehexane, 1-methoxy-
CAS Registry Number4747-07-3
SMILES
CCCCCCOC
InChI Identifier
InChI=1S/C7H16O/c1-3-4-5-6-7-8-2/h3-7H2,1-2H3
InChI KeyICBJCVRQDSQPGI-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
KingdomOrganic compounds
Super ClassOrganic oxygen compounds
ClassOrganooxygen compounds
Sub ClassEthers
Direct ParentDialkyl ethers
Alternative Parents
Substituents
  • Dialkyl ether
  • Hydrocarbon derivative
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External DescriptorsNot Available
Ontology
Physiological effect
Organoleptic effect
Disposition
Biological locationSource
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
Water Solubility0.81 g/LALOGPS
logP2.76ALOGPS
logP2.34ChemAxon
logS-2.2ALOGPS
pKa (Strongest Basic)-4.1ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count1ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area9.23 ŲChemAxon
Rotatable Bond Count5ChemAxon
Refractivity36.09 m³·mol⁻¹ChemAxon
Polarizability15.42 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+125.7431661259
DarkChem[M-H]-122.9831661259
DeepCCS[M+H]+133.53530932474
DeepCCS[M-H]-131.36130932474
DeepCCS[M-2H]-167.25230932474
DeepCCS[M+Na]+142.11630932474
AllCCS[M+H]+129.632859911
AllCCS[M+H-H2O]+125.432859911
AllCCS[M+NH4]+133.632859911
AllCCS[M+Na]+134.732859911
AllCCS[M-H]-133.832859911
AllCCS[M+Na-2H]-137.232859911
AllCCS[M+HCOO]-140.932859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Methyl hexyl etherCCCCCCOC910.1Standard polar33892256
Methyl hexyl etherCCCCCCOC809.6Standard non polar33892256
Methyl hexyl etherCCCCCCOC809.0Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Experimental GC-MSGC-MS Spectrum - Methyl hexyl ether EI-B (Non-derivatized)splash10-052b-9000000000-1e0f4edc8b6e4132c4e12017-09-12HMDB team, MONA, MassBankView Spectrum
Experimental GC-MSGC-MS Spectrum - Methyl hexyl ether EI-B (Non-derivatized)splash10-052b-9000000000-1e0f4edc8b6e4132c4e12018-05-18HMDB team, MONA, MassBankView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Methyl hexyl ether GC-MS (Non-derivatized) - 70eV, Positivesplash10-002e-9000000000-4a887ecbdf2f5bc993792017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Methyl hexyl ether GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 10V, Positive-QTOFsplash10-014i-5900000000-4bccab4e83a6876d99b92016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 20V, Positive-QTOFsplash10-014r-9500000000-b28a513a000b80ad5edd2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 40V, Positive-QTOFsplash10-052f-9000000000-10cb7f27d76a47cb88f02016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 10V, Negative-QTOFsplash10-014i-1900000000-95cac7bb42e05cf348d32016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 20V, Negative-QTOFsplash10-014i-4900000000-2b0ebde2015595911da92016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 40V, Negative-QTOFsplash10-001i-9000000000-2566a5027dc23ccd49f42016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 10V, Positive-QTOFsplash10-052f-9000000000-eaa2f14fef7829c812b92021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 20V, Positive-QTOFsplash10-0a4l-9000000000-9883fb397711dd1cb19e2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 40V, Positive-QTOFsplash10-0006-9000000000-18fe8a3f32c23fecdfcd2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 10V, Negative-QTOFsplash10-014i-0900000000-17b499e45ef26c65acab2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 20V, Negative-QTOFsplash10-02t9-2900000000-8b664d293825962514a82021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Methyl hexyl ether 40V, Negative-QTOFsplash10-0a4l-9000000000-cf743a722620f9a4728b2021-09-24Wishart LabView Spectrum

IR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted IR SpectrumIR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+H]+)2023-02-04FELIX labView Spectrum
Predicted IR SpectrumIR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+Na]+)2023-02-04FELIX labView Spectrum
Biological Properties
Cellular Locations
  • Membrane
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB009842
KNApSAcK IDNot Available
Chemspider ID70849
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound78484
PDB IDNot Available
ChEBI IDNot Available
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. (). EAFUS: Everything Added to Food in the United States.. .