Reference/ChemSpider 1004
type: UnificationXref
id: 1004
db: ChemSpider

Reference/CAS 7722-84-1
type: UnificationXref
id: 7722-84-1
db: CAS

Reference/PubChem-compound 6022
type: UnificationXref
id: 6022
db: PubChem-compound

Reference/ChEBI CHEBI 16137
type: UnificationXref
id: CHEBI:16137
db: ChEBI

Reference/ChemSpider 937
type: UnificationXref
id: 937
db: ChemSpider

Sulfate
type: SmallMoleculeReference
xref: Reference/BioCyc NH42SO4
xref: Reference/CAS 14808-79-8
xref: Reference/PubChem-compound 1117
xref: Reference/HMDB HMDB0001448
xref: Reference/ChemSpider 1085
xref: Reference/KEGG Compound C00059
xref: Reference/ChEBI CHEBI 16189
chemical formula: H2O4S
molecular weight: 97.96738
structure: ChemicalStructure/PW C001118

Reference/HMDB HMDB0003125
type: UnificationXref
id: HMDB0003125
db: HMDB

Reference/HMDB HMDB0000652
type: UnificationXref
id: HMDB0000652
db: HMDB

ChemicalStructure/PW C001420
type: ChemicalStructure
structure format: SMILES
structure data: O

ChemicalStructure/PW C001783
type: ChemicalStructure
structure format: SMILES
structure data: OO

2.8.2.1
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000886 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000043 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040399 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000153 Cytoplasm/Stoichiometry/1.0
right: Phenol sulphate
right: Adenosine 3',5'-diphosphate
spontaneous: false
EC number: 2.8.2.1
left: Phosphoadenosine phosphosulfate
left: Phenol
name: Phenol + Phosphoadenosine phosphosulfate → Adenosine 3',5'-diphosphate + Phenol sulphate
conversion direction: LEFT_TO_RIGHT

2.8.2.4
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000886 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000043 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000094 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001101 Cytoplasm/Stoichiometry/1.0
right: Adenosine 3',5'-diphosphate
right: Estrone sulfate
spontaneous: false
EC number: 2.8.2.4
left: Estrone
left: Phosphoadenosine phosphosulfate
name: Estrone + Phosphoadenosine phosphosulfate → Adenosine 3',5'-diphosphate + Estrone sulfate
conversion direction: LEFT_TO_RIGHT

Phenol
type: SmallMoleculeReference
xref: Reference/PubChem-compound 20488062
xref: Reference/ChEBI CHEBI 15882
xref: Reference/ChemSpider 971
xref: Reference/BioCyc 24-DICHLOROPHENOL
xref: Reference/HMDB HMDB0000228
xref: Reference/CAS 108-95-2
xref: Reference/KEGG Compound C00146
chemical formula: C6H6O
molecular weight: 94.04186
structure: ChemicalStructure/PW C000153

3.1.3.7
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000886 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000793 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001104 Cytoplasm/Stoichiometry/1.0
right: Adenosine phosphosulfate
right: Phosphate
spontaneous: false
EC number: 3.1.3.7
left: Water
left: Phosphoadenosine phosphosulfate
name: Phosphoadenosine phosphosulfate + Water → Adenosine phosphosulfate + Phosphate
conversion direction: LEFT_TO_RIGHT

Reaction146096
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000886 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000793 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001034 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000414 Cytoplasm/Stoichiometry/1.0
right: Adenosine diphosphate
right: Phosphoadenosine phosphosulfate
spontaneous: false
left: Adenosine phosphosulfate
left: Adenosine triphosphate
name: Adenosine phosphosulfate + Adenosine triphosphate → Adenosine diphosphate + Phosphoadenosine phosphosulfate
conversion direction: LEFT_TO_RIGHT

Reaction146095
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001118 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000793 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000170 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000414 Cytoplasm/Stoichiometry/1.0
right: Adenosine phosphosulfate
right: Pyrophosphate
spontaneous: false
left: Sulfate
left: Adenosine triphosphate
name: Adenosine triphosphate + Sulfate → Adenosine phosphosulfate + Pyrophosphate
conversion direction: LEFT_TO_RIGHT

1.8.3.1
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001065 Mitochondrion/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000162 Mitochondrion/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Mitochondrion/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001783 Mitochondrion/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001118 Mitochondrion/Stoichiometry/1.0
right: Hydrogen peroxide
right: Sulfate
spontaneous: false
EC number: 1.8.3.1
left: Sulfite
left: Water
left: Oxygen
name: Oxygen + Sulfite + Water ↔ Hydrogen peroxide + Sulfate
conversion direction: REVERSIBLE

Reference/TAXONOMY 9913
type: UnificationXref
id: 9913
db: TAXONOMY

Reference/ChEBI CHEBI 17359
type: UnificationXref
id: CHEBI:17359
db: ChEBI

Reference/HMDB HMDB0061375
type: UnificationXref
id: HMDB0061375
db: HMDB

Reference/HMDB HMDB0000538
type: UnificationXref
id: HMDB0000538
db: HMDB

Compound/PW C001118 Mitochondrion/Stoichiometry/1.0
type: Stoichiometry
physical entity: Sulfate
stoichiometric coefficient: 1.0

Reference/BioCyc ATP
type: UnificationXref
id: ATP
db: BioCyc

Reference/ChEBI CHEBI 17474
type: UnificationXref
id: CHEBI:17474
db: ChEBI

Reference/CAS 14808-79-8
type: UnificationXref
id: 14808-79-8
db: CAS

Water
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Water

Reference/ChemSpider 559142
type: UnificationXref
id: 559142
db: ChemSpider

Sulfotransferase 1A1
type: ProteinReference
xref: Reference/UniProt Q3T0S9
organism: Bos taurus

Reference/BioCyc ADP
type: UnificationXref
id: ADP
db: BioCyc

Estrogen sulfotransferase
type: ProteinReference
xref: Reference/UniProt P19217
organism: Bos taurus

Adenosine 3',5'-diphosphate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 17985
xref: Reference/CAS 1053-73-2
xref: Reference/PubChem-compound 159296
xref: Reference/ChemSpider 140102
xref: Reference/BioCyc 3-5-ADP
xref: Reference/KEGG Compound C00054
xref: Reference/HMDB HMDB0000061
chemical formula: C10H15N5O10P2
molecular weight: 427.02942
structure: ChemicalStructure/PW C000043

Sulfite
type: SmallMoleculeReference
xref: Reference/CAS 14265-45-3
xref: Reference/BioCyc SO3
xref: Reference/ChEBI CHEBI 17359
xref: Reference/ChemSpider 1068
xref: Reference/KEGG Compound C00094
xref: Reference/HMDB HMDB0000240
xref: Reference/PubChem-compound 1099
chemical formula: H2O3S
molecular weight: 81.972466
structure: ChemicalStructure/PW C000162

Adenosine phosphosulfate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Adenosine phosphosulfate

ReactionCatalysis136223
type: Catalysis
controller: 3'-phosphoadenosine 5'-phosphosulfate synthase 2
controlled: Reaction146096
control type: ACTIVATION

ReactionCatalysis136224
type: Catalysis
controller: 3'(2'),5'-bisphosphate nucleotidase 1
controlled: 3.1.3.7
control type: ACTIVATION

Reference/PubChem-compound 5870
type: UnificationXref
id: 5870
db: PubChem-compound

ReactionCatalysis136225
type: Catalysis
controller: Estrogen sulfotransferase
controlled: 2.8.2.4
control type: ACTIVATION

ReactionCatalysis136226
type: Catalysis
controller: Sulfotransferase 1A1
controlled: 2.8.2.1
control type: ACTIVATION

ReactionCatalysis136221
type: Catalysis
controller: Sulfite oxidase, mitochondrial
controlled: 1.8.3.1
control type: ACTIVATION

Sulfotransferase 1A1
type: Complex
component stoichiometry: Protein/15906 Cytoplasm/Stoichiometry/2.0
cellular location: Cytoplasm
component: Sulfotransferase 1A1

Chondroitin
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 16137
xref: Reference/CAS 9007-27-6
xref: Reference/PubChem-compound 53477707
xref: Reference/KEGG Compound C00401
xref: Reference/HMDB HMDB0000629
chemical formula: C14H21NO11
molecular weight: 379.11145
structure: ChemicalStructure/PW C000489

ReactionCatalysis136222
type: Catalysis
controller: 3'-phosphoadenosine 5'-phosphosulfate synthase 2
controlled: Reaction146095
control type: ACTIVATION

Reference/ChemSpider 5742
type: UnificationXref
id: 5742
db: ChemSpider

Reference/BioCyc ESTRONE-SULFATE
type: UnificationXref
id: ESTRONE-SULFATE
db: BioCyc

ReactionCatalysis136227
type: Catalysis
controller: Sulfotransferase 1A1
controlled: 2.8.2.2
control type: ACTIVATION

Reference/PubChem-compound 1031
type: UnificationXref
id: 1031
db: PubChem-compound

ReactionCatalysis136228
type: Catalysis
controller: Carbohydrate sulfotransferase
controlled: 2.8.2.5
control type: ACTIVATION

Reference/ChemSpider 952
type: UnificationXref
id: 952
db: ChemSpider

Reference/GENE ONTOLOGY GO 0005829
type: UnificationXref
id: GO:0005829
db: GENE ONTOLOGY

Estrone sulfate
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001425
xref: Reference/KEGG Compound C02538
xref: Reference/ChemSpider 2272513
xref: Reference/BioCyc ESTRONE-SULFATE
xref: Reference/PubChem-compound 3001028
xref: Reference/CAS 481-97-0
xref: Reference/ChEBI CHEBI 17474
chemical formula: C18H22O5S
molecular weight: 350.1188
structure: ChemicalStructure/PW C001101

ChemicalStructure/PW C000793
type: ChemicalStructure
structure format: SMILES

3'-phosphoadenosine 5'-phosphosulfate synthase 2
type: Protein
cellular location: Cytoplasm
entity reference: 3'-phosphoadenosine 5'-phosphosulfate synthase 2

Carbohydrate sulfotransferase
type: ProteinReference
xref: Reference/UniProt F1N663
organism: Bos taurus

Phosphoadenosine phosphosulfate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Phosphoadenosine phosphosulfate

Reference/KEGG Compound C00468
type: UnificationXref
id: C00468
db: KEGG Compound

Phosphate
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00009
xref: Reference/PubChem-compound 1061
xref: Reference/CAS 14265-44-2
xref: Reference/HMDB HMDB0001429
xref: Reference/BioCyc CPD-8587
xref: Reference/ChEBI CHEBI 18367
xref: Reference/ChemSpider 1032
chemical formula: O4P
molecular weight: 94.95342
structure: ChemicalStructure/PW C001104

Reference/ChEBI CHEBI 16240
type: UnificationXref
id: CHEBI:16240
db: ChEBI

Chondroitin 4-sulfate
type: SmallMolecule
cellular location: Cytosol
entity reference: Chondroitin 4-sulfate

Reference/PathWhiz PW088235
type: UnificationXref
id: PW088235
db: PathWhiz

Reference/KEGG Compound C00224
type: UnificationXref
id: C00224
db: KEGG Compound

Reference/BioCyc 24-DICHLOROPHENOL
type: UnificationXref
id: 24-DICHLOROPHENOL
db: BioCyc

Reference/BioCyc PPI
type: UnificationXref
id: PPI
db: BioCyc

Reference/BioCyc 3-5-ADP
type: UnificationXref
id: 3-5-ADP
db: BioCyc

Mitochondrion
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005739

Reference/HMDB HMDB0060015
type: UnificationXref
id: HMDB0060015
db: HMDB

Adenosine 3',5'-diphosphate
type: SmallMolecule
cellular location: Cytosol
entity reference: Adenosine 3',5'-diphosphate

Reference/ChEBI CHEBI 15882
type: UnificationXref
id: CHEBI:15882
db: ChEBI

3'(2'),5'-bisphosphate nucleotidase 1
type: ProteinReference
xref: Reference/UniProt A7E3X5
organism: Bos taurus

3'-phosphoadenosine 5'-phosphosulfate synthase 2
type: ProteinReference
xref: Reference/UniProt Q0VC88
organism: Bos taurus

Reference/CAS 1053-73-2
type: UnificationXref
id: 1053-73-2
db: CAS

Reference/CAS 71-23-8
type: UnificationXref
id: 71-23-8
db: CAS

Protein/15906 Cytoplasm/Stoichiometry/2.0
type: Stoichiometry
physical entity: Sulfotransferase 1A1
stoichiometric coefficient: 2.0

Sulfate/Sulfite Metabolism
type: Pathway
pathway order: PathwayEnzymeReaction/2112396
pathway order: PathwayEnzymeReaction/2112397
pathway order: PathwayEnzymeReaction/2112394
pathway order: PathwayEnzymeReaction/2112395
pathway order: PathwayEnzymeReaction/2112398
pathway order: PathwayEnzymeReaction/2112392
pathway order: PathwayEnzymeReaction/2112393
pathway order: PathwayEnzymeReaction/2112391
pathway component: 1.8.3.1
pathway component: ReactionCatalysis136223
pathway component: ReactionCatalysis136224
pathway component: ReactionCatalysis136225
pathway component: ReactionCatalysis136226
pathway component: ReactionCatalysis136221
pathway component: ReactionCatalysis136222
pathway component: ReactionCatalysis136227
pathway component: ReactionCatalysis136228
pathway component: 2.8.2.5
pathway component: 2.8.2.2
pathway component: 2.8.2.1
pathway component: 2.8.2.4
pathway component: 3.1.3.7
pathway component: Reaction146096
pathway component: Reaction146095
xref: Reference/SMPDB SMP0087216
xref: Reference/PathWhiz PW088235
organism: Bos taurus

Sulfite oxidase
type: ProteinReference
xref: Reference/UniProt Q3MHX0
organism: Bos taurus

Reference/KEGG Compound C02538
type: UnificationXref
id: C02538
db: KEGG Compound

Reference/ChEBI CHEBI 17263
type: UnificationXref
id: CHEBI:17263
db: ChEBI

Reference/CAS 108-95-2
type: UnificationXref
id: 108-95-2
db: CAS

Cytosol
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005829

Reference/BioCyc CPD-6641
type: UnificationXref
id: CPD-6641
db: BioCyc

ChemicalStructure/PW C000489
type: ChemicalStructure
structure format: SMILES

Reference/PubChem-compound 74426
type: UnificationXref
id: 74426
db: PubChem-compound

Reference/PubChem-compound 3001028
type: UnificationXref
id: 3001028
db: PubChem-compound

Water
type: SmallMolecule
cellular location: Mitochondrion
entity reference: Water

Reference/UniProt A7E3X5
type: UnificationXref
id: A7E3X5
db: UniProt

ChemicalStructure/PW C001104
type: ChemicalStructure
structure format: SMILES
structure data: [O-]P([O-])([O-])=O

Reference/HMDB HMDB0001425
type: UnificationXref
id: HMDB0001425
db: HMDB

Reference/ChemSpider 67018
type: UnificationXref
id: 67018
db: ChemSpider

Reference/CAS 9007-27-6
type: UnificationXref
id: 9007-27-6
db: CAS

ChemicalStructure/PW C001101
type: ChemicalStructure
structure format: SMILES

Compound/PW C001101 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Estrone sulfate
stoichiometric coefficient: 1.0

Reference/KEGG Compound C00009
type: UnificationXref
id: C00009
db: KEGG Compound

Reference/KEGG Compound C00008
type: UnificationXref
id: C00008
db: KEGG Compound

Reference/KEGG Compound C00007
type: UnificationXref
id: C00007
db: KEGG Compound

Chondroitin 4-sulfate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 37397
xref: Reference/KEGG Compound C00634
xref: Reference/HMDB HMDB0000652
xref: Reference/ChemSpider 30776543
xref: Reference/BioCyc CHONDROITIN-4-SULFATE
xref: Reference/PubChem-compound 70678574
chemical formula: C14H21NO15S
molecular weight: 475.0632
structure: ChemicalStructure/PW C000510

Reference/KEGG Compound C00001
type: UnificationXref
id: C00001
db: KEGG Compound

Reference/HMDB HMDB0001429
type: UnificationXref
id: HMDB0001429
db: HMDB

Reference/ChemSpider 9799
type: UnificationXref
id: 9799
db: ChemSpider

Reference/ChEBI CHEBI 18361
type: UnificationXref
id: CHEBI:18361
db: ChEBI

Reference/ChEBI CHEBI 18367
type: UnificationXref
id: CHEBI:18367
db: ChEBI

Reference/ChEBI CHEBI 16189
type: UnificationXref
id: CHEBI:16189
db: ChEBI

Reference/ChemSpider 1032
type: UnificationXref
id: 1032
db: ChemSpider

Reference/KEGG Compound C00002
type: UnificationXref
id: C00002
db: KEGG Compound

Compound/PW C001065 Mitochondrion/Stoichiometry/1.0
type: Stoichiometry
physical entity: Oxygen
stoichiometric coefficient: 1.0

Reference/BioCyc APS
type: UnificationXref
id: APS
db: BioCyc

Sulfotransferase 1A1
type: Protein
cellular location: Cytoplasm
entity reference: Sulfotransferase 1A1

Reference/ChEBI CHEBI 28831
type: UnificationXref
id: CHEBI:28831
db: ChEBI

Chondroitin
type: SmallMolecule
cellular location: Cytosol
entity reference: Chondroitin

Reference/PubChem-compound 159296
type: UnificationXref
id: 159296
db: PubChem-compound

Reference/HMDB HMDB0000228
type: UnificationXref
id: HMDB0000228
db: HMDB

Estrone
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Estrone

Reference/CAS 937-34-8
type: UnificationXref
id: 937-34-8
db: CAS

Estrone sulfate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Estrone sulfate

Reference/ChEBI CHEBI 17709
type: UnificationXref
id: CHEBI:17709
db: ChEBI

Reference/ChemSpider 1068
type: UnificationXref
id: 1068
db: ChemSpider

Compound/PW C000162 Mitochondrion/Stoichiometry/1.0
type: Stoichiometry
physical entity: Sulfite
stoichiometric coefficient: 1.0

Compound/PW C000170 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Pyrophosphate
stoichiometric coefficient: 1.0

Adenosine triphosphate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Adenosine triphosphate

Propyl sulfate
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0061375
xref: Reference/PubChem-compound 70469
xref: Reference/ChemSpider 63647
chemical formula: C3H8O4S
molecular weight: 140.01433
structure: ChemicalStructure/PW C040706

Oxygen
type: SmallMolecule
cellular location: Mitochondrion
entity reference: Oxygen

Reference/KEGG Compound C00013
type: UnificationXref
id: C00013
db: KEGG Compound

Reference/ChemSpider 5660
type: UnificationXref
id: 5660
db: ChemSpider

Pyrophosphate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 644102
xref: Reference/BioCyc PPI
xref: Reference/ChemSpider 559142
xref: Reference/ChEBI CHEBI 18361
xref: Reference/HMDB HMDB0000250
xref: Reference/CAS 14000-31-8
xref: Reference/KEGG Compound C00013
chemical formula: O7P2
molecular weight: 173.91193
structure: ChemicalStructure/PW C000170

Sulfotransferase 1A1
type: Protein
cellular location: Cytosol
entity reference: Sulfotransferase 1A1

Reference/PubChem-compound 1117
type: UnificationXref
id: 1117
db: PubChem-compound

Compound/PW C001420 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0001448
type: UnificationXref
id: HMDB0001448
db: HMDB

Reference/PubChem-compound 5957
type: UnificationXref
id: 5957
db: PubChem-compound

Reference/SMPDB SMP0087216
type: UnificationXref
id: SMP0087216
db: SMPDB

Propyl sulfate
type: SmallMolecule
cellular location: Cytosol
entity reference: Propyl sulfate

Phenol sulphate
type: SmallMoleculeReference
xref: Reference/ChemSpider 67018
xref: Reference/ChEBI CHEBI 27905
xref: Reference/HMDB HMDB0060015
xref: Reference/CAS 937-34-8
xref: Reference/PubChem-compound 74426
xref: Reference/KEGG Compound C00850
chemical formula: C6H6O4S
molecular weight: 173.99867
structure: ChemicalStructure/PW C040399

Reference/CAS 56-65-5
type: UnificationXref
id: 56-65-5
db: CAS

Compound/PW C000489 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Chondroitin
stoichiometric coefficient: 1.0

Reference/KEGG Compound C00027
type: UnificationXref
id: C00027
db: KEGG Compound

Reference/KEGG Compound C00146
type: UnificationXref
id: C00146
db: KEGG Compound

Reference/GENE ONTOLOGY GO 0005739
type: UnificationXref
id: GO:0005739
db: GENE ONTOLOGY

Adenosine diphosphate
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00008
xref: Reference/PubChem-compound 6022
xref: Reference/ChemSpider 5800
xref: Reference/CAS 58-64-0
xref: Reference/BioCyc ADP
xref: Reference/ChEBI CHEBI 16761
xref: Reference/HMDB HMDB0001341
chemical formula: C10H15N5O10P2
molecular weight: 427.02942
structure: ChemicalStructure/PW C001034

Reference/GENE ONTOLOGY GO 0005737
type: UnificationXref
id: GO:0005737
db: GENE ONTOLOGY

Phenol sulphate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Phenol sulphate

Compound/PW C001420 Mitochondrion/Stoichiometry/1.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 1.0

Reference/CAS 482-67-7
type: UnificationXref
id: 482-67-7
db: CAS

Reference/HMDB HMDB0000240
type: UnificationXref
id: HMDB0000240
db: HMDB

3'(2'),5'-bisphosphate nucleotidase 1
type: Protein
cellular location: Cytoplasm
entity reference: 3'(2'),5'-bisphosphate nucleotidase 1

Reference/ChEBI CHEBI 17985
type: UnificationXref
id: CHEBI:17985
db: ChEBI

Reference/ChemSpider 1085
type: UnificationXref
id: 1085
db: ChemSpider

Propyl alcohol
type: SmallMolecule
cellular location: Cytosol
entity reference: Propyl alcohol

Reference/BioCyc CPD-8587
type: UnificationXref
id: CPD-8587
db: BioCyc

Reference/UniProt Q3T0S9
type: UnificationXref
id: Q3T0S9
db: UniProt

Compound/PW C000510 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Chondroitin 4-sulfate
stoichiometric coefficient: 1.0

Reference/PubChem-compound 1099
type: UnificationXref
id: 1099
db: PubChem-compound

Reference/ChEBI CHEBI 17980
type: UnificationXref
id: CHEBI:17980
db: ChEBI

Protein/15903 Cytoplasm/Stoichiometry/2.0
type: Stoichiometry
physical entity: Estrogen sulfotransferase
stoichiometric coefficient: 2.0

Reference/BioCyc HYDROGEN-PEROXIDE
type: UnificationXref
id: HYDROGEN-PEROXIDE
db: BioCyc

Compound/PW C001104 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phosphate
stoichiometric coefficient: 1.0

Estrogen sulfotransferase
type: Protein
cellular location: Cytoplasm
entity reference: Estrogen sulfotransferase

Adenosine phosphosulfate
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001003
xref: Reference/CAS 485-84-7
xref: Reference/BioCyc APS
xref: Reference/ChemSpider 9821
xref: Reference/PubChem-compound 10238
xref: Reference/KEGG Compound C00224
xref: Reference/ChEBI CHEBI 17709
chemical formula: C10H14N5O10PS
molecular weight: 427.0199
structure: ChemicalStructure/PW C000793

Reference/PubChem-compound 53477707
type: UnificationXref
id: 53477707
db: PubChem-compound

Reference/HMDB HMDB0000250
type: UnificationXref
id: HMDB0000250
db: HMDB

ChemicalStructure/PW C000170
type: ChemicalStructure
structure format: SMILES
structure data: [O-]P([O-])(=O)OP([O-])([O-])=O

Reference/CAS 14000-31-8
type: UnificationXref
id: 14000-31-8
db: CAS

Reference/HMDB HMDB0001341
type: UnificationXref
id: HMDB0001341
db: HMDB

Phenol
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Phenol

Reference/KEGG Compound C05979
type: UnificationXref
id: C05979
db: KEGG Compound

Compound/PW C000153 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phenol
stoichiometric coefficient: 1.0

Reference/PubChem-compound 10238
type: UnificationXref
id: 10238
db: PubChem-compound

ChemicalStructure/PW C001034
type: ChemicalStructure
structure format: SMILES

Reference/HMDB HMDB0000145
type: UnificationXref
id: HMDB0000145
db: HMDB

Reference/ChemSpider 763
type: UnificationXref
id: 763
db: ChemSpider

Bos taurus
type: BioSource
xref: Reference/TAXONOMY 9913

Reference/HMDB HMDB0000820
type: UnificationXref
id: HMDB0000820
db: HMDB

Cytoplasm
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005737

Reference/BioCyc SO3
type: UnificationXref
id: SO3
db: BioCyc

Reference/BioCyc NH42SO4
type: UnificationXref
id: NH42SO4
db: BioCyc

Reference/PubChem-compound 784
type: UnificationXref
id: 784
db: PubChem-compound

Reference/ChEBI CHEBI 15422
type: UnificationXref
id: CHEBI:15422
db: ChEBI

Compound/PW C001118 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Sulfate
stoichiometric coefficient: 1.0

Phosphoadenosine phosphosulfate
type: SmallMoleculeReference
xref: Reference/BioCyc PAPS
xref: Reference/HMDB HMDB0001134
xref: Reference/CAS 482-67-7
xref: Reference/ChemSpider 9799
xref: Reference/KEGG Compound C00053
xref: Reference/PubChem-compound 10214
xref: Reference/ChEBI CHEBI 17980
chemical formula: C10H15N5O13P2S
molecular weight: 506.98624
structure: ChemicalStructure/PW C000886

Reference/ChemSpider 140102
type: UnificationXref
id: 140102
db: ChemSpider

ChemicalStructure/PW C001118
type: ChemicalStructure
structure format: SMILES
structure data: OS(O)(=O)=O

Reference/ChemSpider 9821
type: UnificationXref
id: 9821
db: ChemSpider

Reference/BioCyc ESTRONE
type: UnificationXref
id: ESTRONE
db: BioCyc

Reference/KEGG Compound C00054
type: UnificationXref
id: C00054
db: KEGG Compound

Reference/KEGG Compound C00053
type: UnificationXref
id: C00053
db: KEGG Compound

Reference/CAS 7732-18-5
type: UnificationXref
id: 7732-18-5
db: CAS

Reference/KEGG Compound C00059
type: UnificationXref
id: C00059
db: KEGG Compound

Reference/KEGG Compound C00850
type: UnificationXref
id: C00850
db: KEGG Compound

Reference/HMDB HMDB0001003
type: UnificationXref
id: HMDB0001003
db: HMDB

Estrone
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000145
xref: Reference/PubChem-compound 5870
xref: Reference/KEGG Compound C00468
xref: Reference/CAS 53-16-7
xref: Reference/ChEBI CHEBI 17263
xref: Reference/BioCyc ESTRONE
xref: Reference/ChemSpider 5660
chemical formula: C18H22O2
molecular weight: 270.162
structure: ChemicalStructure/PW C000094

ChemicalStructure/PW C000153
type: ChemicalStructure
structure format: SMILES
structure data: OC1=CC=CC=C1

Oxygen
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001377
xref: Reference/ChemSpider 952
xref: Reference/KEGG Compound C00007
xref: Reference/ChEBI CHEBI 15379
xref: Reference/PubChem-compound 977
xref: Reference/BioCyc CPD-6641
xref: Reference/CAS 7782-44-7
chemical formula: O2
molecular weight: 31.98983
structure: ChemicalStructure/PW C001065

Compound/PW C040706 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Propyl sulfate
stoichiometric coefficient: 1.0

Sulfate
type: SmallMolecule
cellular location: Mitochondrion
entity reference: Sulfate

Adenosine diphosphate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Adenosine diphosphate

Sulfite oxidase
type: Protein
cellular location: Mitochondrion
entity reference: Sulfite oxidase

Sulfite
type: SmallMolecule
cellular location: Mitochondrion
entity reference: Sulfite

Adenosine triphosphate
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15422
xref: Reference/PubChem-compound 5957
xref: Reference/HMDB HMDB0000538
xref: Reference/CAS 56-65-5
xref: Reference/ChemSpider 5742
xref: Reference/BioCyc ATP
xref: Reference/KEGG Compound C00002
chemical formula: C10H16N5O13P3
molecular weight: 506.99576
structure: ChemicalStructure/PW C000414

Propyl alcohol
type: SmallMoleculeReference
xref: Reference/ChemSpider 1004
xref: Reference/ChEBI CHEBI 28831
xref: Reference/CAS 71-23-8
xref: Reference/HMDB HMDB0000820
xref: Reference/KEGG Compound C05979
xref: Reference/PubChem-compound 1031
xref: Reference/BioCyc PROPANOL
chemical formula: C3H8O
molecular weight: 60.057514
structure: ChemicalStructure/PW C000655

Reference/PubChem-compound 10214
type: UnificationXref
id: 10214
db: PubChem-compound

Reference/ChEBI CHEBI 16761
type: UnificationXref
id: CHEBI:16761
db: ChEBI

Reference/CAS 7782-44-7
type: UnificationXref
id: 7782-44-7
db: CAS

Pyrophosphate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Pyrophosphate

Reference/HMDB HMDB0001377
type: UnificationXref
id: HMDB0001377
db: HMDB

Reference/CAS 485-84-7
type: UnificationXref
id: 485-84-7
db: CAS

Reference/HMDB HMDB0001134
type: UnificationXref
id: HMDB0001134
db: HMDB

ChemicalStructure/PW C000043
type: ChemicalStructure
structure format: SMILES

Carbohydrate sulfotransferase
type: Protein
cellular location: Cytosol
entity reference: Carbohydrate sulfotransferase

ChemicalStructure/PW C000162
type: ChemicalStructure
structure format: SMILES
structure data: OS(O)=O

Compound/PW C040399 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phenol sulphate
stoichiometric coefficient: 1.0

Compound/PW C000094 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Estrone
stoichiometric coefficient: 1.0

2.8.2.5
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000489 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000043 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000510 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000886 Cytosol/Stoichiometry/1.0
right: Adenosine 3',5'-diphosphate
right: Chondroitin 4-sulfate
spontaneous: false
EC number: 2.8.2.5
left: Chondroitin
left: Phosphoadenosine phosphosulfate
name: Chondroitin + Phosphoadenosine phosphosulfate → Adenosine 3',5'-diphosphate + Chondroitin 4-sulfate
conversion direction: LEFT_TO_RIGHT

2.8.2.2
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000655 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040706 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000043 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000886 Cytosol/Stoichiometry/1.0
right: Adenosine 3',5'-diphosphate
right: Propyl sulfate
spontaneous: false
EC number: 2.8.2.2
left: Phosphoadenosine phosphosulfate
left: Propyl alcohol
name: Phosphoadenosine phosphosulfate + Propyl alcohol → Adenosine 3',5'-diphosphate + Propyl sulfate
conversion direction: LEFT_TO_RIGHT

Compound/PW C000043 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine 3',5'-diphosphate
stoichiometric coefficient: 1.0

Reference/PubChem-compound 962
type: UnificationXref
id: 962
db: PubChem-compound

Protein/15893 Mitochondrion/Stoichiometry/2.0
type: Stoichiometry
physical entity: Sulfite oxidase
stoichiometric coefficient: 2.0

Reference/ChEBI CHEBI 37397
type: UnificationXref
id: CHEBI:37397
db: ChEBI

Reference/KEGG Compound C00634
type: UnificationXref
id: C00634
db: KEGG Compound

Reference/CAS 53-16-7
type: UnificationXref
id: 53-16-7
db: CAS

Reference/ChemSpider 5800
type: UnificationXref
id: 5800
db: ChemSpider

Reference/PubChem-compound 70469
type: UnificationXref
id: 70469
db: PubChem-compound

Compound/PW C001783 Mitochondrion/Stoichiometry/1.0
type: Stoichiometry
physical entity: Hydrogen peroxide
stoichiometric coefficient: 1.0

ChemicalStructure/PW C000886
type: ChemicalStructure
structure format: SMILES

Reference/ChEBI CHEBI 27905
type: UnificationXref
id: CHEBI:27905
db: ChEBI

Compound/PW C001034 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine diphosphate
stoichiometric coefficient: 1.0

ChemicalStructure/PW C040706
type: ChemicalStructure
structure format: SMILES
structure data: CCCOS(O)(=O)=O

Sulfate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Sulfate

Reference/BioCyc PAPS
type: UnificationXref
id: PAPS
db: BioCyc

ChemicalStructure/PW C001065
type: ChemicalStructure
structure format: SMILES
structure data: O=O

Reference/ChemSpider 971
type: UnificationXref
id: 971
db: ChemSpider

Hydrogen peroxide
type: SmallMolecule
cellular location: Mitochondrion
entity reference: Hydrogen peroxide

Reference/HMDB HMDB0002111
type: UnificationXref
id: HMDB0002111
db: HMDB

ChemicalStructure/PW C000094
type: ChemicalStructure
structure format: SMILES

Reference/BioCyc PROPANOL
type: UnificationXref
id: PROPANOL
db: BioCyc

Reference/ChEBI CHEBI 15377
type: UnificationXref
id: CHEBI:15377
db: ChEBI

ChemicalStructure/PW C040399
type: ChemicalStructure
structure format: SMILES
structure data: OS(=O)(=O)OC1=CC=CC=C1

Reference/ChEBI CHEBI 15379
type: UnificationXref
id: CHEBI:15379
db: ChEBI

Estrogen sulfotransferase
type: Complex
component stoichiometry: Protein/15903 Cytoplasm/Stoichiometry/2.0
cellular location: Cytoplasm
component: Estrogen sulfotransferase

Reference/CAS 14265-44-2
type: UnificationXref
id: 14265-44-2
db: CAS

Compound/PW C000043 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine 3',5'-diphosphate
stoichiometric coefficient: 1.0

Reference/ChemSpider 30776543
type: UnificationXref
id: 30776543
db: ChemSpider

Reference/CAS 58-64-0
type: UnificationXref
id: 58-64-0
db: CAS

Sulfite oxidase, mitochondrial
type: Complex
component stoichiometry: Protein/15893 Mitochondrion/Stoichiometry/2.0
cellular location: Mitochondrion
component: Sulfite oxidase

ChemicalStructure/PW C000414
type: ChemicalStructure
structure format: SMILES

Reference/ChemSpider 2272513
type: UnificationXref
id: 2272513
db: ChemSpider

ChemicalStructure/PW C000655
type: ChemicalStructure
structure format: SMILES
structure data: CCCO

Adenosine 3',5'-diphosphate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Adenosine 3',5'-diphosphate

Reference/KEGG Compound C00401
type: UnificationXref
id: C00401
db: KEGG Compound

Compound/PW C000414 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine triphosphate
stoichiometric coefficient: 1.0

Phosphate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Phosphate

Compound/PW C000655 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Propyl alcohol
stoichiometric coefficient: 1.0

Reference/UniProt P19217
type: UnificationXref
id: P19217
db: UniProt

Reference/KEGG Compound C00094
type: UnificationXref
id: C00094
db: KEGG Compound

Reference/HMDB HMDB0000061
type: UnificationXref
id: HMDB0000061
db: HMDB

Reference/PubChem-compound 70678574
type: UnificationXref
id: 70678574
db: PubChem-compound

Reference/CAS 481-97-0
type: UnificationXref
id: 481-97-0
db: CAS

Reference/PubChem-compound 20488062
type: UnificationXref
id: 20488062
db: PubChem-compound

Reference/PubChem-compound 644102
type: UnificationXref
id: 644102
db: PubChem-compound

Compound/PW C000886 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phosphoadenosine phosphosulfate
stoichiometric coefficient: 1.0

Compound/PW C000793 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Adenosine phosphosulfate
stoichiometric coefficient: 1.0

Reference/UniProt F1N663
type: UnificationXref
id: F1N663
db: UniProt

Reference/HMDB HMDB0000629
type: UnificationXref
id: HMDB0000629
db: HMDB

ChemicalStructure/PW C000510
type: ChemicalStructure
structure format: SMILES

Water
type: SmallMoleculeReference
xref: Reference/PubChem-compound 962
xref: Reference/ChEBI CHEBI 15377
xref: Reference/KEGG Compound C00001
xref: Reference/ChemSpider 937
xref: Reference/HMDB HMDB0002111
xref: Reference/CAS 7732-18-5
chemical formula: H2O
molecular weight: 18.010565
structure: ChemicalStructure/PW C001420

Hydrogen peroxide
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0003125
xref: Reference/PubChem-compound 784
xref: Reference/ChemSpider 763
xref: Reference/CAS 7722-84-1
xref: Reference/BioCyc HYDROGEN-PEROXIDE
xref: Reference/ChEBI CHEBI 16240
xref: Reference/KEGG Compound C00027
chemical formula: H2O2
molecular weight: 34.005478
structure: ChemicalStructure/PW C001783

Reference/BioCyc CHONDROITIN-4-SULFATE
type: UnificationXref
id: CHONDROITIN-4-SULFATE
db: BioCyc

Reference/CAS 14265-45-3
type: UnificationXref
id: 14265-45-3
db: CAS

Reference/PubChem-compound 1061
type: UnificationXref
id: 1061
db: PubChem-compound

Reference/PubChem-compound 977
type: UnificationXref
id: 977
db: PubChem-compound

Reference/ChemSpider 63647
type: UnificationXref
id: 63647
db: ChemSpider

Reference/UniProt Q0VC88
type: UnificationXref
id: Q0VC88
db: UniProt

Reference/UniProt Q3MHX0
type: UnificationXref
id: Q3MHX0
db: UniProt

Phosphoadenosine phosphosulfate
type: SmallMolecule
cellular location: Cytosol
entity reference: Phosphoadenosine phosphosulfate

Compound/PW C000886 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Phosphoadenosine phosphosulfate
stoichiometric coefficient: 1.0