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Showing metabocard for 1-Nitronaphthalene-5,6-oxide (HMDB0060331)

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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2013-05-17 00:54:17 UTC
Update Date2023-02-21 17:29:52 UTC
HMDB IDHMDB0060331
Secondary Accession Numbers
  • HMDB60331
Metabolite Identification
Common Name1-Nitronaphthalene-5,6-oxide
Description1-Nitronaphthalene-5,6-oxide belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups. 1-Nitronaphthalene-5,6-oxide is an extremely weak basic (essentially neutral) compound (based on its pKa). 1-Nitronaphthalene-5,6-oxide exists in all living organisms, ranging from bacteria to humans. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups.
Structure
Data?1677000592
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

Structure #1
  Mrv0541 02241206562D          

 14 16  0  0  0  0            999 V2000
    2.8061    1.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9865    1.9946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1339    1.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3309   -0.0874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5113    0.0073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8226    0.5751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4948    1.3321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6422    0.4804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1835    0.7643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6753    1.4268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9700   -0.2766    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7896   -0.3713    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4783   -0.9391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1443    1.5214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  5  9  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
 10 14  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  2  0  0  0  0
M  END
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3D MOL for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

HMDB0060331
     RDKit          3D
1-Nitronaphthalene-5,6-oxide
 21 23  0  0  0  0  0  0  0  0999 V2000
    1.9942   -2.6900   -0.5299 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2900   -1.6348    0.0166 N   0  0  0  0  0  4  0  0  0  0  0  0
    3.5134   -1.6320    0.6914 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.5627   -0.4287    0.0178 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2686    0.7981    0.0122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6401    2.0141    0.0164 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2730    2.0213    0.0271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4787    0.8473    0.0342 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1785   -0.3745    0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6298   -1.5820   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9592   -1.5734   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6881   -0.2833   -0.0404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5391    0.5132   -1.1955 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9344    0.9029    0.0955 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3462    0.7570    0.0049 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1680    2.9519    0.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2830    2.9449    0.0296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0915   -2.5325    0.0143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4838   -2.5150   -0.0451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7438   -0.3161    0.3063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4033    1.8117    0.5342 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
  9  4  1  0
 14 12  1  0
 14  8  1  0
  5 15  1  0
  6 16  1  0
  7 17  1  0
 10 18  1  0
 11 19  1  0
 12 20  1  0
 14 21  1  0
M  CHG  2   2   1   3  -1
M  END
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3D SDF for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

Structure #1
  Mrv0541 02241206562D          

 14 16  0  0  0  0            999 V2000
    2.8061    1.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9865    1.9946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1339    1.1429    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3309   -0.0874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5113    0.0073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8226    0.5751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4948    1.3321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6422    0.4804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1835    0.7643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6753    1.4268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9700   -0.2766    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7896   -0.3713    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4783   -0.9391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1443    1.5214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  5  9  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
 10 14  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  2  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0060331

> <DATABASE_NAME>
hmdb

> <SMILES>
O=N(=O)C1=CC=CC2=C1C=CC1OC21

> <INCHI_IDENTIFIER>
InChI=1S/C10H7NO3/c12-11(13)8-3-1-2-7-6(8)4-5-9-10(7)14-9/h1-5,9-10H

> <INCHI_KEY>
GSAMVXYBVGOJMK-UHFFFAOYSA-N

> <FORMULA>
C10H7NO3

> <MOLECULAR_WEIGHT>
189.1675

> <EXACT_MASS>
189.042593095

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_AVERAGE_POLARIZABILITY>
17.54898775475008

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
5-nitro-1aH,7aH-naphtho[1,2-b]oxirene

> <ALOGPS_LOGP>
1.94

> <JCHEM_LOGP>
2.0981589130000007

> <ALOGPS_LOGS>
-2.58

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-4.267018683765622

> <JCHEM_POLAR_SURFACE_AREA>
58.35

> <JCHEM_REFRACTIVITY>
51.19440000000001

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
5.00e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
1-nitronaphthalene-5,6-oxide

> <JCHEM_VEBER_RULE>
0

$$$$
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3D-SDF for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

HMDB0060331
     RDKit          3D
1-Nitronaphthalene-5,6-oxide
 21 23  0  0  0  0  0  0  0  0999 V2000
    1.9942   -2.6900   -0.5299 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2900   -1.6348    0.0166 N   0  0  0  0  0  4  0  0  0  0  0  0
    3.5134   -1.6320    0.6914 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.5627   -0.4287    0.0178 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2686    0.7981    0.0122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6401    2.0141    0.0164 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2730    2.0213    0.0271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4787    0.8473    0.0342 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1785   -0.3745    0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6298   -1.5820   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9592   -1.5734   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6881   -0.2833   -0.0404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5391    0.5132   -1.1955 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9344    0.9029    0.0955 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3462    0.7570    0.0049 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1680    2.9519    0.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2830    2.9449    0.0296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0915   -2.5325    0.0143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4838   -2.5150   -0.0451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7438   -0.3161    0.3063 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4033    1.8117    0.5342 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
  9  4  1  0
 14 12  1  0
 14  8  1  0
  5 15  1  0
  6 16  1  0
  7 17  1  0
 10 18  1  0
 11 19  1  0
 12 20  1  0
 14 21  1  0
M  CHG  2   2   1   3  -1
M  END
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PDB for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Structure #1                                      
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0       5.238   3.546   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       3.708   3.723   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       5.850   2.133   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.484  -0.163   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.954   0.014   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       3.402   1.074   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       2.790   2.487   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.932   0.897   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       0.343   1.427   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       1.261   2.663   0.000  0.00  0.00           C+0
HETATM   11  N   UNK     0       5.544  -0.516   0.000  0.00  0.00           N+0
HETATM   12  O   UNK     0       7.074  -0.693   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0       4.626  -1.753   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0      -0.269   2.840   0.000  0.00  0.00           O+0
CONECT    1    2    3                                                       
CONECT    2    1    7                                                       
CONECT    3    1    8                                                       
CONECT    4    5    6                                                       
CONECT    5    4    9                                                       
CONECT    6    4    7    8                                                  
CONECT    7    2    6   10                                                  
CONECT    8    3    6   11                                                  
CONECT    9    5   10   14                                                  
CONECT   10    7    9   14                                                  
CONECT   11    8   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11                                                            
CONECT   14    9   10                                                       
MASTER        0    0    0    0    0    0    0    0   14    0   32    0
END
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3D PDB for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

COMPND    HMDB0060331
HETATM    1  O1  UNL     1       1.994  -2.690  -0.530  1.00  0.00           O  
HETATM    2  N1  UNL     1       2.290  -1.635   0.017  1.00  0.00           N1+
HETATM    3  O2  UNL     1       3.513  -1.632   0.691  1.00  0.00           O1-
HETATM    4  C1  UNL     1       1.563  -0.429   0.018  1.00  0.00           C  
HETATM    5  C2  UNL     1       2.269   0.798   0.012  1.00  0.00           C  
HETATM    6  C3  UNL     1       1.640   2.014   0.016  1.00  0.00           C  
HETATM    7  C4  UNL     1       0.273   2.021   0.027  1.00  0.00           C  
HETATM    8  C5  UNL     1      -0.479   0.847   0.034  1.00  0.00           C  
HETATM    9  C6  UNL     1       0.178  -0.374   0.029  1.00  0.00           C  
HETATM   10  C7  UNL     1      -0.630  -1.582  -0.000  1.00  0.00           C  
HETATM   11  C8  UNL     1      -1.959  -1.573  -0.030  1.00  0.00           C  
HETATM   12  C9  UNL     1      -2.688  -0.283  -0.040  1.00  0.00           C  
HETATM   13  O3  UNL     1      -2.539   0.513  -1.196  1.00  0.00           O  
HETATM   14  C10 UNL     1      -1.934   0.903   0.096  1.00  0.00           C  
HETATM   15  H1  UNL     1       3.346   0.757   0.005  1.00  0.00           H  
HETATM   16  H2  UNL     1       2.168   2.952   0.012  1.00  0.00           H  
HETATM   17  H3  UNL     1      -0.283   2.945   0.030  1.00  0.00           H  
HETATM   18  H4  UNL     1      -0.092  -2.532   0.014  1.00  0.00           H  
HETATM   19  H5  UNL     1      -2.484  -2.515  -0.045  1.00  0.00           H  
HETATM   20  H6  UNL     1      -3.744  -0.316   0.306  1.00  0.00           H  
HETATM   21  H7  UNL     1      -2.403   1.812   0.534  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    4    5    5    9
CONECT    5    6   15
CONECT    6    7    7   16
CONECT    7    8   17
CONECT    8    9    9   14
CONECT    9   10
CONECT   10   11   11   18
CONECT   11   12   19
CONECT   12   13   14   20
CONECT   13   14
CONECT   14   21
END
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SMILES for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

O=N(=O)C1=CC=CC2=C1C=CC1OC21
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INCHI for HMDB0060331 (1-Nitronaphthalene-5,6-oxide)

InChI=1S/C10H7NO3/c12-11(13)8-3-1-2-7-6(8)4-5-9-10(7)14-9/h1-5,9-10H
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View in JSmolView Stereo Labels
SynonymsNot Available
Chemical FormulaC10H7NO3
Average Molecular Weight189.1675
Monoisotopic Molecular Weight189.042593095
IUPAC Name5-nitro-1aH,7aH-naphtho[1,2-b]oxirene
Traditional Name1-nitronaphthalene-5,6-oxide
CAS Registry NumberNot Available
SMILES
O=N(=O)C1=CC=CC2=C1C=CC1OC21
InChI Identifier
InChI=1S/C10H7NO3/c12-11(13)8-3-1-2-7-6(8)4-5-9-10(7)14-9/h1-5,9-10H
InChI KeyGSAMVXYBVGOJMK-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups.
KingdomOrganic compounds
Super ClassBenzenoids
ClassNaphthalenes
Sub ClassNitronaphthalenes
Direct ParentNitronaphthalenes
Alternative Parents
Substituents
  • 1-nitronaphthalene
  • Nitroaromatic compound
  • C-nitro compound
  • Organic nitro compound
  • Dialkyl ether
  • Oxirane
  • Ether
  • Organic oxoazanium
  • Allyl-type 1,3-dipolar organic compound
  • Propargyl-type 1,3-dipolar organic compound
  • Organic 1,3-dipolar compound
  • Organoheterocyclic compound
  • Oxacycle
  • Organic nitrogen compound
  • Organic oxygen compound
  • Organonitrogen compound
  • Organopnictogen compound
  • Organooxygen compound
  • Hydrocarbon derivative
  • Organic oxide
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological locationSource
Process
Naturally occurring process
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
Predicted Chromatographic Properties
Spectra
Biological Properties
Cellular Locations
  • Membrane (predicted from logP)
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 IDNot Available
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDC14800
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound11954051
PDB IDNot Available
ChEBI ID34105
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. Magrane M: UniProt Knowledgebase: a hub of integrated protein data. Database (Oxford). 2011 Mar 29;2011:bar009. doi: 10.1093/database/bar009. Print 2011. [PubMed:21447597 ]
  2. Brunk E, Sahoo S, Zielinski DC, Altunkaya A, Drager A, Mih N, Gatto F, Nilsson A, Preciat Gonzalez GA, Aurich MK, Prlic A, Sastry A, Danielsdottir AD, Heinken A, Noronha A, Rose PW, Burley SK, Fleming RMT, Nielsen J, Thiele I, Palsson BO: Recon3D enables a three-dimensional view of gene variation in human metabolism. Nat Biotechnol. 2018 Mar;36(3):272-281. doi: 10.1038/nbt.4072. Epub 2018 Feb 19. [PubMed:29457794 ]

Only showing the first 10 proteins. There are 20 proteins in total.

Show all enzymes and transporters

Enzymes

Enzyme Details
1. Glutathione S-transferase Mu 2
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTM2
Uniprot ID:
P28161
Molecular weight:
25744.395
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
2. Glutathione S-transferase Mu 1
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTM1
Uniprot ID:
P09488
Molecular weight:
25711.555
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
3. Glutathione S-transferase kappa 1
General function:
Involved in protein disulfide oxidoreductase activity
Specific function:
Significant glutathione conjugating activity is found only with the model substrate, 1-chloro-2,4-dinitrobenzene (CDNB).
Gene Name:
GSTK1
Uniprot ID:
Q9Y2Q3
Molecular weight:
31565.605
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
4. Microsomal glutathione S-transferase 3
General function:
Involved in glutathione transferase activity
Specific function:
Also functions as a glutathione peroxidase.
Gene Name:
MGST3
Uniprot ID:
O14880
Molecular weight:
16516.185
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
5. Glutathione S-transferase Mu 3
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles. May govern uptake and detoxification of both endogenous compounds and xenobiotics at the testis and brain blood barriers.
Gene Name:
GSTM3
Uniprot ID:
P21266
Molecular weight:
26559.32
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
6. Glutathione S-transferase A1
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTA1
Uniprot ID:
P08263
Molecular weight:
25630.785
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
7. Microsomal glutathione S-transferase 1
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles. Has a wide substrate specificity.
Gene Name:
MGST1
Uniprot ID:
P10620
Molecular weight:
17598.45
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
8. Glutathione S-transferase Mu 4
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles. Active on 1-chloro-2,4-dinitrobenzene.
Gene Name:
GSTM4
Uniprot ID:
Q03013
Molecular weight:
25561.095
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
9. Glutathione S-transferase Mu 5
General function:
Involved in glutathione transferase activity
Specific function:
Conjugation of reduced glutathione to a wide number of exogenous and endogenous hydrophobic electrophiles.
Gene Name:
GSTM5
Uniprot ID:
P46439
Molecular weight:
25674.455
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails
Enzyme Details
10. Microsomal glutathione S-transferase 2
General function:
Involved in enzyme activator activity
Specific function:
Can catalyze the production of LTC4 from LTA4 and reduced glutathione. Can catalyze the conjugation of 1-chloro-2,4-dinitrobenzene with reduced glutathione.
Gene Name:
MGST2
Uniprot ID:
Q99735
Molecular weight:
16620.4
Reactions
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalenedetails
1-Nitronaphthalene-5,6-oxide + Glutathione → 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalenedetails

Only showing the first 10 proteins. There are 20 proteins in total.

Show all enzymes and transporters