Reference/PubChem-compound 10404448
type: UnificationXref
id: 10404448
db: PubChem-compound

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

SubPathwayInteraction118562
type: Interaction
name: SubPathwayReaction
name: SubPathway118562Reaction
participant: 5-Hydroxyomeprazole
participant: 3-Hydroxyomeprazole
participant: Omeprazole sulfone
participant: 5'-O-Desmethyl omeprazole

Reference/HMDB HMDB0014010
type: UnificationXref
id: HMDB0014010
db: HMDB

Reference/PubChem-compound 71587579
type: UnificationXref
id: 71587579
db: PubChem-compound

Compound/PW C008689/Stoichiometry/1.0
type: Stoichiometry
physical entity: 5-Hydroxyomeprazole
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0014012
type: UnificationXref
id: HMDB0014012
db: HMDB

Reference/HMDB HMDB0014011
type: UnificationXref
id: HMDB0014011
db: HMDB

Compound/PW C008690/Stoichiometry/1.0
type: Stoichiometry
physical entity: 5'-O-Desmethyl omeprazole
stoichiometric coefficient: 1.0

Reference/HMDB HMDB0014013
type: UnificationXref
id: HMDB0014013
db: HMDB

Reference/PubChem-compound 439153
type: UnificationXref
id: 439153
db: PubChem-compound

Compound/PW C008691/Stoichiometry/1.0
type: Stoichiometry
physical entity: Omeprazole sulfone
stoichiometric coefficient: 1.0

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

Reference/PathWhiz PW127157
type: UnificationXref
id: PW127157
db: PathWhiz

Cytochrome P450 3A4
type: Protein
cellular location: Endoplasmic Reticulum Membrane
entity reference: Cytochrome P450 3A4

3-Hydroxyomeprazole
type: SmallMolecule
entity reference: 3-Hydroxyomeprazole
name: SubPathwayInput

Omeprazole sulfone
type: SmallMolecule
entity reference: Omeprazole sulfone
name: SubPathwayInput

5'-O-Desmethyl omeprazole
type: SmallMolecule
entity reference: 5'-O-Desmethyl omeprazole
name: SubPathwayInput

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

Cytochrome P450 3A4
type: ProteinReference
xref: Reference/UniProt P08684
organism: BiologicalState973

3-Hydroxyomeprazole
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: 3-Hydroxyomeprazole

Solute carrier family 22 member 7
type: ProteinReference
xref: Reference/UniProt Q9Y694

Canalicular multispecific organic anion transporter 2
type: ProteinReference
xref: Reference/UniProt O15438

Reference/UniProt O15438
type: UnificationXref
id: O15438
db: UniProt

5-Hydroxyomeprazole
type: SmallMoleculeReference
xref: Reference/CAS 92340-57-3
xref: Reference/HMDB HMDB0014010
xref: Reference/PubChem-compound 119560
xref: Reference/ChemSpider 106763
xref: Reference/ChEBI CHEBI 63840
chemical formula: C17H19N3O4S
molecular weight: 361.10962
structure: ChemicalStructure/PW C008689

5-Hydroxyomeprazole
type: SmallMolecule
entity reference: 5-Hydroxyomeprazole
name: SubPathwayInput

Reference/ChEBI CHEBI 15846
type: UnificationXref
id: CHEBI:15846
db: ChEBI

Compound/PW C008692/Stoichiometry/1.0
type: Stoichiometry
physical entity: 3-Hydroxyomeprazole
stoichiometric coefficient: 1.0

Reference/UniProt P33261
type: UnificationXref
id: P33261
db: UniProt

Reference/CELL TYPE ONTOLOGY CL 0000182
type: UnificationXref
id: CL:0000182
db: CELL TYPE ONTOLOGY

Reference/BRENDA TISSUE ONTOLOGY BTO 0000759
type: UnificationXref
id: BTO:0000759
db: BRENDA TISSUE ONTOLOGY

Reference/PubChem-compound 1038
type: UnificationXref
id: 1038
db: PubChem-compound

Compound/PW C001065 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Oxygen
stoichiometric coefficient: 1.0

Hydrogen Ion
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: Hydrogen Ion

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

Reference/HMDB HMDB0001520
type: UnificationXref
id: HMDB0001520
db: HMDB

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

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

Formaldehyde
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 16842
xref: Reference/BioCyc FORMALDEHYDE
xref: Reference/HMDB HMDB0001426
xref: Reference/PubChem-compound 712
xref: Reference/ChemSpider 692
xref: Reference/KEGG Compound C00067
xref: Reference/CAS 50-00-0
chemical formula: CH2O
molecular weight: 30.010565
structure: ChemicalStructure/PW C001102

Compound/PW C001102 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Formaldehyde
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 16908
type: UnificationXref
id: CHEBI:16908
db: ChEBI

Reference/PubChem-compound 445395
type: UnificationXref
id: 445395
db: PubChem-compound

Reference/CAS 92340-57-3
type: UnificationXref
id: 92340-57-3
db: CAS

Transport14612
type: Transport
participant stoichiometry: Compound/PW C008692 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008692/Stoichiometry/1.0
right: 3-Hydroxyomeprazole
spontaneous: false
left: 3-Hydroxyomeprazole
name: 3-Hydroxyomeprazole (→) Transport: Homo sapiens, Liver, Hepatocyte, Endoplasmic Reticulum Membrane to Homo sapiens, Blood Vessel
conversion direction: LEFT_TO_RIGHT

Transport14611
type: Transport
participant stoichiometry: Compound/PW C008690 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008690/Stoichiometry/1.0
right: 5'-O-Desmethyl omeprazole
spontaneous: false
left: 5'-O-Desmethyl omeprazole
name: 5'-O-Desmethyl omeprazole (→) Transport: Homo sapiens, Liver, Hepatocyte, Endoplasmic Reticulum Membrane to Homo sapiens, Blood Vessel
conversion direction: LEFT_TO_RIGHT

Reference/ChemSpider 1010
type: UnificationXref
id: 1010
db: ChemSpider

Cytochrome P450 2C19
type: ProteinReference
xref: Reference/UniProt P33261
organism: BiologicalState973

Transport14613
type: Transport
participant stoichiometry: Compound/PW C008691/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008691 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
right: Omeprazole sulfone
spontaneous: false
left: Omeprazole sulfone
name: Omeprazole sulfone (→) Transport: Homo sapiens, Liver, Hepatocyte, Endoplasmic Reticulum Membrane to Homo sapiens, Blood Vessel
conversion direction: LEFT_TO_RIGHT

Transport14610
type: Transport
participant stoichiometry: Compound/PW C008689 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008689/Stoichiometry/1.0
right: 5-Hydroxyomeprazole
spontaneous: false
left: 5-Hydroxyomeprazole
name: 5-Hydroxyomeprazole (→) Transport: Homo sapiens, Liver, Hepatocyte, Endoplasmic Reticulum Membrane to Homo sapiens, Blood Vessel
conversion direction: LEFT_TO_RIGHT

Compound/PW C008692 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: 3-Hydroxyomeprazole
stoichiometric coefficient: 1.0

Reference/CAS 5666-16-0
type: UnificationXref
id: 5666-16-0
db: CAS

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

Transport14605
type: Transport
participant stoichiometry: Compound/PW C001274/Stoichiometry/1.0
right: Omeprazole
spontaneous: false
left: Omeprazole
name: Omeprazole (→) Transport: Homo sapiens, Intestine to Homo sapiens, Blood Vessel
conversion direction: LEFT_TO_RIGHT

Transport14604
type: Transport
participant stoichiometry: Compound/PW C001274/Stoichiometry/1.0
right: Omeprazole
spontaneous: false
left: Omeprazole
name: Omeprazole (→) Transport: Homo sapiens to Homo sapiens, Intestine
conversion direction: LEFT_TO_RIGHT

Reference/ChemSpider 4433
type: UnificationXref
id: 4433
db: ChemSpider

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

Transport14606
type: Transport
participant stoichiometry: Compound/PW C001274 Cytosol/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001274/Stoichiometry/1.0
right: Omeprazole
spontaneous: false
left: Omeprazole
name: Omeprazole (→) Transport: Homo sapiens, Blood Vessel to Homo sapiens, Liver, Hepatocyte, Cytosol
conversion direction: LEFT_TO_RIGHT

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

Reference/SMPDB SMP0125593
type: UnificationXref
id: SMP0125593
db: SMPDB

Compound/PW C000891 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: FMNH2
stoichiometric coefficient: 1.0

Reference/CAS 58-68-4
type: UnificationXref
id: 58-68-4
db: CAS

Reference/PubChem-compound 145900
type: UnificationXref
id: 145900
db: PubChem-compound

ChemicalStructure/PW C001102
type: ChemicalStructure
structure format: SMILES
structure data: C=O

Reference/HMDB HMDB0001426
type: UnificationXref
id: HMDB0001426
db: HMDB

Reference/ChemSpider 692
type: UnificationXref
id: 692
db: ChemSpider

Compound/PW C001144 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: NADH
stoichiometric coefficient: 1.0

Reference/PubChem-compound 119560
type: UnificationXref
id: 119560
db: PubChem-compound

NADH
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: NADH

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

Oxygen
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: Oxygen

Formaldehyde
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: Formaldehyde

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

Reference/KEGG Compound C00004
type: UnificationXref
id: C00004
db: KEGG Compound

Reference/KEGG Compound C00003
type: UnificationXref
id: C00003
db: KEGG Compound

Liver
type: TissueVocabulary
xref: Reference/BRENDA TISSUE ONTOLOGY BTO 0000759

Reference/ChemSpider 559060
type: UnificationXref
id: 559060
db: ChemSpider

Flavin Mononucleotide
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001520
xref: Reference/BioCyc FMN
xref: Reference/ChemSpider 559060
xref: Reference/CAS 146-17-8
xref: Reference/ChEBI CHEBI 17621
xref: Reference/PubChem-compound 643976
xref: Reference/KEGG Compound C00061
chemical formula: C17H21N4O9P
molecular weight: 456.1046
structure: ChemicalStructure/PW C001170

Excretion
type: Pathway
pathway order: SubPathwayInteractionSteps/SubPathway118562
pathway component: SubPathwayInteraction118562
name: SubPathway

Compound/PW C008691 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Omeprazole sulfone
stoichiometric coefficient: 1.0

5-Hydroxyomeprazole
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: 5-Hydroxyomeprazole

NAD
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15846
xref: Reference/HMDB HMDB0000902
xref: Reference/CAS 53-84-9
xref: Reference/KEGG Compound C00003
xref: Reference/PubChem-compound 5893
xref: Reference/BioCyc NAD
xref: Reference/ChemSpider 5682
chemical formula: C21H27N7O14P2
molecular weight: 663.10913
structure: ChemicalStructure/PW C000721

Reference/HMDB HMDB0000902
type: UnificationXref
id: HMDB0000902
db: HMDB

Reference/KEGG Compound C07324
type: UnificationXref
id: C07324
db: KEGG Compound

NADH
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0001487
xref: Reference/CAS 58-68-4
xref: Reference/PubChem-compound 439153
xref: Reference/BioCyc NADH
xref: Reference/ChemSpider 388299
xref: Reference/KEGG Compound C00004
xref: Reference/ChEBI CHEBI 16908
chemical formula: C21H29N7O14P2
molecular weight: 665.12476
structure: ChemicalStructure/PW C001144

3-Hydroxyomeprazole
type: SmallMoleculeReference
xref: Reference/ChemSpider 32697733
xref: Reference/PubChem-compound 71587579
xref: Reference/HMDB HMDB0014013
chemical formula: C17H19N3O4S
molecular weight: 361.10962
structure: ChemicalStructure/PW C008692

Omeprazole sulfone
type: SmallMoleculeReference
xref: Reference/PubChem-compound 145900
xref: Reference/CAS 88546-55-8
xref: Reference/ChEBI CHEBI 388428
xref: Reference/HMDB HMDB0014012
xref: Reference/ChemSpider 128709
chemical formula: C17H19N3O4S
molecular weight: 361.10962
structure: ChemicalStructure/PW C008691

5'-O-Desmethyl omeprazole
type: SmallMoleculeReference
xref: Reference/ChemSpider 8579886
xref: Reference/PubChem-compound 10404448
xref: Reference/HMDB HMDB0014011
chemical formula: C16H17N3O3S
molecular weight: 331.09906
structure: ChemicalStructure/PW C008690

Hepatocyte
type: CellVocabulary
xref: Reference/CELL TYPE ONTOLOGY CL 0000182

Reference/ChEBI CHEBI 16048
type: UnificationXref
id: CHEBI:16048
db: ChEBI

Hydrogen Ion
type: SmallMoleculeReference
xref: Reference/KEGG Compound C00080
xref: Reference/ChEBI CHEBI 15378
xref: Reference/HMDB HMDB0059597
xref: Reference/PubChem-compound 1038
xref: Reference/ChemSpider 1010
chemical formula: H
molecular weight: 1.007825
structure: ChemicalStructure/PW C040034

Reference/ChEBI CHEBI 16842
type: UnificationXref
id: CHEBI:16842
db: ChEBI

Compound/PW C001274 Cytosol/Stoichiometry/1.0
type: Stoichiometry
physical entity: Omeprazole
stoichiometric coefficient: 1.0

Reference/CAS 53-84-9
type: UnificationXref
id: 53-84-9
db: CAS

Reference/ChemSpider 32697733
type: UnificationXref
id: 32697733
db: ChemSpider

Omeprazole
type: SmallMoleculeReference
xref: Reference/CAS 73590-58-6
xref: Reference/PubChem-compound 4594
xref: Reference/HMDB HMDB0001913
xref: Reference/ChEBI CHEBI 77260
xref: Reference/ChemSpider 4433
xref: Reference/KEGG Compound C07324
chemical formula: C17H19N3O3S
molecular weight: 345.11472
structure: ChemicalStructure/PW C001274

Compound/PW C008690 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: 5'-O-Desmethyl omeprazole
stoichiometric coefficient: 1.0

Reference/ChemSpider 8579886
type: UnificationXref
id: 8579886
db: ChemSpider

Omeprazole
type: SmallMolecule
entity reference: Omeprazole

Reference/ChEBI CHEBI 17621
type: UnificationXref
id: CHEBI:17621
db: ChEBI

Endoplasmic Reticulum Membrane
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005789

ChemicalStructure/PW C000721
type: ChemicalStructure
structure format: SMILES

Reference/ChemSpider 106763
type: UnificationXref
id: 106763
db: ChemSpider

Reference/ChemSpider 5682
type: UnificationXref
id: 5682
db: ChemSpider

ChemicalStructure/PW C001144
type: ChemicalStructure
structure format: SMILES

ChemicalStructure/PW C008692
type: ChemicalStructure
structure format: SMILES

ChemicalStructure/PW C008690
type: ChemicalStructure
structure format: SMILES

ChemicalStructure/PW C008691
type: ChemicalStructure
structure format: SMILES

Reference/PubChem-compound 4594
type: UnificationXref
id: 4594
db: PubChem-compound

ChemicalStructure/PW C001274
type: ChemicalStructure
structure format: SMILES

Compound/PW C008689 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: 5-Hydroxyomeprazole
stoichiometric coefficient: 1.0

NAD
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: NAD

TransportCatalysis5426
type: Catalysis
controller: Canalicular multispecific organic anion transporter 2
controlled: Transport14613
control type: ACTIVATION

Reference/PubChem-compound 643976
type: UnificationXref
id: 643976
db: PubChem-compound

TransportCatalysis5424
type: Catalysis
controller: Canalicular multispecific organic anion transporter 2
controlled: Transport14611
control type: ACTIVATION

TransportCatalysis5425
type: Catalysis
controller: Canalicular multispecific organic anion transporter 2
controlled: Transport14612
control type: ACTIVATION

TransportCatalysis5423
type: Catalysis
controller: Canalicular multispecific organic anion transporter 2
controlled: Transport14610
control type: ACTIVATION

Homo sapiens
type: BioSource
xref: Reference/TAXONOMY 9606

Reference/HMDB HMDB0001913
type: UnificationXref
id: HMDB0001913
db: HMDB

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

Reference/ChemSpider 388299
type: UnificationXref
id: 388299
db: ChemSpider

Compound/PW C001420 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Water
stoichiometric coefficient: 1.0

Water
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: Water

Reference/HMDB HMDB0001487
type: UnificationXref
id: HMDB0001487
db: HMDB

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

Reference/GENE ONTOLOGY GO 0005789
type: UnificationXref
id: GO:0005789
db: GENE ONTOLOGY

Reference/KEGG Compound C00061
type: UnificationXref
id: C00061
db: KEGG Compound

TransportCatalysis5420
type: Catalysis
controller: Canalicular multispecific organic anion transporter 2
controlled: Transport14605
control type: ACTIVATION

TransportCatalysis5421
type: Catalysis
controller: Solute carrier family 22 member 7
controlled: Transport14606
control type: ACTIVATION

FMNH2
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 16048
xref: Reference/BioCyc FMNH2
xref: Reference/KEGG Compound C01847
xref: Reference/PubChem-compound 445395
xref: Reference/CAS 5666-16-0
xref: Reference/ChemSpider 393046
xref: Reference/HMDB HMDB0001142
chemical formula: C17H23N4O9P
molecular weight: 458.12027
structure: ChemicalStructure/PW C000891

Reference/UniProt Q9Y694
type: UnificationXref
id: Q9Y694
db: UniProt

Reference/CAS 146-17-8
type: UnificationXref
id: 146-17-8
db: CAS

Reference/KEGG Compound C00067
type: UnificationXref
id: C00067
db: KEGG Compound

BiologicalState973
type: BioSource
cell type: Hepatocyte
xref: Reference/TAXONOMY 9606
name: Homo sapiens, Liver, Hepatocyte
tissue: Liver

Omeprazole
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: Omeprazole

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

Compound/PW C001274 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Omeprazole
stoichiometric coefficient: 1.0

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

Cytochrome P450 2C19
type: Protein
cellular location: Endoplasmic Reticulum Membrane
entity reference: Cytochrome P450 2C19

ChemicalStructure/PW C008689
type: ChemicalStructure
structure format: SMILES

Reference/ChEBI CHEBI 388428
type: UnificationXref
id: CHEBI:388428
db: ChEBI

Reference/ChEBI CHEBI 77260
type: UnificationXref
id: CHEBI:77260
db: ChEBI

Reference/TAXONOMY 9606
type: UnificationXref
id: 9606
db: TAXONOMY

Reference/CAS 73590-58-6
type: UnificationXref
id: 73590-58-6
db: CAS

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

Compound/PW C000721 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: NAD
stoichiometric coefficient: 1.0

Reference/CAS 88546-55-8
type: UnificationXref
id: 88546-55-8
db: CAS

Reference/KEGG Compound C01847
type: UnificationXref
id: C01847
db: KEGG Compound

Compound/PW C040034 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Hydrogen Ion
stoichiometric coefficient: 1.0

Compound/PW C001274/Stoichiometry/1.0
type: Stoichiometry
physical entity: Omeprazole
stoichiometric coefficient: 1.0

Reference/PubChem-compound 5893
type: UnificationXref
id: 5893
db: PubChem-compound

ChemicalStructure/PW C000891
type: ChemicalStructure
structure format: SMILES

Reference/KEGG Compound C00080
type: UnificationXref
id: C00080
db: KEGG Compound

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

Solute carrier family 22 member 7
type: Protein
entity reference: Solute carrier family 22 member 7

Canalicular multispecific organic anion transporter 2
type: Protein
entity reference: Canalicular multispecific organic anion transporter 2

Reference/HMDB HMDB0001142
type: UnificationXref
id: HMDB0001142
db: HMDB

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

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

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

Reference/ChEBI CHEBI 15378
type: UnificationXref
id: CHEBI:15378
db: ChEBI

ChemicalStructure/PW C040034
type: ChemicalStructure
structure format: SMILES
structure data: [H+]

Reference/UniProt P08684
type: UnificationXref
id: P08684
db: UniProt

Reference/PubChem-compound 712
type: UnificationXref
id: 712
db: PubChem-compound

Reaction219019
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001274 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001170 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008689 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000891 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
right: Water
right: Flavin Mononucleotide
right: 5-Hydroxyomeprazole
right: Hydrogen Ion
spontaneous: false
left: Oxygen
left: FMNH2
left: Omeprazole
name: FMNH2 + Omeprazole + Oxygen → 5-Hydroxyomeprazole + Flavin Mononucleotide + Hydrogen Ion + Water
conversion direction: LEFT_TO_RIGHT

Reaction219023
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001274 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000721 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001144 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008691 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
right: Water
right: NAD
right: Omeprazole sulfone
right: Hydrogen Ion
spontaneous: false
left: NADH
left: Oxygen
left: Omeprazole
name: NADH + Omeprazole + Oxygen → Hydrogen Ion + NAD + Omeprazole sulfone + Water
conversion direction: LEFT_TO_RIGHT

Reaction219022
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001274 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001170 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008692 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000891 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
right: Water
right: Flavin Mononucleotide
right: 3-Hydroxyomeprazole
right: Hydrogen Ion
spontaneous: false
left: Oxygen
left: FMNH2
left: Omeprazole
name: FMNH2 + Omeprazole + Oxygen → 3-Hydroxyomeprazole + Flavin Mononucleotide + Hydrogen Ion + Water
conversion direction: LEFT_TO_RIGHT

1.14.13.-
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001274 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000721 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C008690 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001144 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001102 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
right: Water
right: Formaldehyde
right: NAD
right: 5'-O-Desmethyl omeprazole
spontaneous: false
EC number: 1.14.13.-
left: NADH
left: Oxygen
left: Omeprazole
name: NADH + Omeprazole + Oxygen → 5'-O-Desmethyl omeprazole + Formaldehyde + NAD + Water
conversion direction: LEFT_TO_RIGHT

Omeprazole sulfone
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: Omeprazole sulfone

Reference/ChEBI CHEBI 63840
type: UnificationXref
id: CHEBI:63840
db: ChEBI

5'-O-Desmethyl omeprazole
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: 5'-O-Desmethyl omeprazole

Omeprazole Metabolism
type: Pathway
pathway order: PathwayTransport/2512968
pathway order: PathwayTransport/2512967
pathway order: PathwaySubPathway/118562
pathway order: PathwayEnzymeReaction/2513003
pathway order: PathwayEnzymeReaction/2513004
pathway order: PathwayEnzymeReaction/2513002
pathway order: PathwayTransport/2513008
pathway order: PathwayTransport/2513009
pathway order: PathwayTransport/2512899
pathway order: PathwayTransport/2513005
pathway order: PathwayEnzymeReaction/2512969
pathway order: PathwayTransport/2513006
pathway component: TransportCatalysis5426
pathway component: TransportCatalysis5424
pathway component: TransportCatalysis5425
pathway component: TransportCatalysis5423
pathway component: Transport14605
pathway component: Transport14604
pathway component: Transport14606
pathway component: Transport14612
pathway component: Transport14611
pathway component: Reaction219019
pathway component: ReactionCatalysis208478
pathway component: Transport14613
pathway component: Transport14610
pathway component: Reaction219023
pathway component: Reaction219022
pathway component: ReactionCatalysis208482
pathway component: 1.14.13.-
pathway component: ReactionCatalysis208481
pathway component: TransportCatalysis5420
pathway component: ReactionCatalysis208480
pathway component: TransportCatalysis5421
pathway component: Excretion
xref: Reference/PathWhiz PW127157
xref: Reference/SMPDB SMP0125593
organism: Homo sapiens

FMNH2
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: FMNH2

ReactionCatalysis208478
type: Catalysis
controller: Cytochrome P450 2C19
controlled: Reaction219019
control type: ACTIVATION

Reference/BioCyc FMNH2
type: UnificationXref
id: FMNH2
db: BioCyc

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

Compound/PW C001170 Endoplasmic Reticulum Membrane/Stoichiometry/1.0
type: Stoichiometry
physical entity: Flavin Mononucleotide
stoichiometric coefficient: 1.0

Reference/ChemSpider 393046
type: UnificationXref
id: 393046
db: ChemSpider

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

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

Flavin Mononucleotide
type: SmallMolecule
cellular location: Endoplasmic Reticulum Membrane
entity reference: Flavin Mononucleotide

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

Reference/HMDB HMDB0059597
type: UnificationXref
id: HMDB0059597
db: HMDB

Reference/CAS 50-00-0
type: UnificationXref
id: 50-00-0
db: CAS

ReactionCatalysis208482
type: Catalysis
controller: Cytochrome P450 3A4
controlled: Reaction219023
control type: ACTIVATION

ReactionCatalysis208481
type: Catalysis
controller: Cytochrome P450 3A4
controlled: Reaction219022
control type: ACTIVATION

ReactionCatalysis208480
type: Catalysis
controller: Cytochrome P450 2C19
controlled: 1.14.13.-
control type: ACTIVATION

Reference/ChemSpider 128709
type: UnificationXref
id: 128709
db: ChemSpider

ChemicalStructure/PW C001170
type: ChemicalStructure
structure format: SMILES