Acetyl-CoA
type: SmallMoleculeReference
xref: Reference/BioCyc ACETYL-COA
xref: Reference/PubChem-compound 444493
xref: Reference/HMDB HMDB0001206
xref: Reference/ChemSpider 392413
xref: Reference/CAS 72-89-9
xref: Reference/ChEBI CHEBI 15351
xref: Reference/KEGG Compound C00024
chemical formula: C23H38N7O17P3S
molecular weight: 809.1258
structure: ChemicalStructure/PW C000940

Compound/PW C013230 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: (E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid
stoichiometric coefficient: 1.0

Reference/PubChem-compound 5280361
type: UnificationXref
id: 5280361
db: PubChem-compound

Reference/ChEBI CHEBI 35697
type: UnificationXref
id: CHEBI:35697
db: ChEBI

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

3-phenylpropionate/cinnamic acid dioxygenase ferredoxin--NAD(+) reductase component
type: Protein
cellular location: Cytoplasm
entity reference: 3-phenylpropionate/cinnamic acid dioxygenase ferredoxin--NAD(+) reductase component

2-Hydroxy-2,4-pentadienoate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: 2-Hydroxy-2,4-pentadienoate

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

Reference/CAS 110-17-8
type: UnificationXref
id: 110-17-8
db: CAS

Reference/PubChem-compound 21883788
type: UnificationXref
id: 21883788
db: PubChem-compound

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

Reference/CAS 621-82-9
type: UnificationXref
id: 621-82-9
db: CAS

4-hydroxy-2-oxopentanoate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: 4-hydroxy-2-oxopentanoate

Reference/ChEBI CHEBI 31082
type: UnificationXref
id: CHEBI:31082
db: ChEBI

Reference/ChEBI CHEBI 58222
type: UnificationXref
id: CHEBI:58222
db: ChEBI

3-phenylpropionate-dihydrodiol/cinnamic acid-dihydrodiol dehydrogenase
type: Protein
cellular location: Cytoplasm
entity reference: 3-phenylpropionate-dihydrodiol/cinnamic acid-dihydrodiol dehydrogenase

(E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid
type: SmallMoleculeReference
xref: Reference/PubChem-compound 193669
xref: Reference/ChEBI CHEBI 48681
xref: Reference/KEGG Compound C12623
xref: Reference/CAS 31082-90-3
xref: Reference/ChemSpider 4445343
xref: Reference/HMDB HMDB0032057
chemical formula: C9H8O4
molecular weight: 180.04225
structure: ChemicalStructure/PW C013230

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

Reference/PubChem-compound 6816
type: UnificationXref
id: 6816
db: PubChem-compound

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

Acetaldehyde dehydrogenase
type: ProteinReference
organism: Klebsiella electrica

TransportCatalysis8080
type: Catalysis
controller: Uncharacterized MFS-type transporter electrica_00264
controlled: Transport23475
control type: ACTIVATION

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

Pyruvic acid
type: SmallMoleculeReference
xref: Reference/PubChem-compound 1060
xref: Reference/HMDB HMDB0000243
xref: Reference/CAS 127-17-3
xref: Reference/BioCyc PYRUVATE
xref: Reference/KEGG Compound C00022
xref: Reference/ChEBI CHEBI 32816
xref: Reference/ChemSpider 1031
chemical formula: C3H4O3
molecular weight: 88.016045
structure: ChemicalStructure/PW C000164

TCA Cycle
type: Pathway
pathway order: SubPathwayInteractionSteps/SubPathway257013
pathway component: SubPathwayInteraction257013
xref: Reference/SMPDB SMP0268882
xref: Reference/PathWhiz PW270676
name: SubPathway

Reference/ChemSpider 4445343
type: UnificationXref
id: 4445343
db: ChemSpider

2,3-dihydroxyphenylpropionate/2,3-dihydroxicinnamic acid 1,2-dioxygenase
type: Protein
cellular location: Cytoplasm
entity reference: 2,3-dihydroxyphenylpropionate/2,3-dihydroxicinnamic acid 1,2-dioxygenase

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

4-hydroxy-2-oxopentanoate
type: SmallMoleculeReference
xref: Reference/KEGG Compound C03589
xref: Reference/ChEBI CHEBI 58222
chemical formula: C5H7O4
molecular weight: 131.03499
structure: ChemicalStructure/PW C040749

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

Compound/PW C001099 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Coenzyme A
stoichiometric coefficient: 1.0

Compound/PW C040749 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: 4-hydroxy-2-oxopentanoate
stoichiometric coefficient: 1.0

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

2-Hydroxy-6-ketononatrienedioate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 5282147
xref: Reference/ChEBI CHEBI 31082
chemical formula: C9H8O6
molecular weight: 212.03209
structure: ChemicalStructure/PW C041168

trans-Cinnamic acid
type: SmallMolecule
cellular location: Extracellular Space
entity reference: trans-Cinnamic acid

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

Reference/ChEBI CHEBI 48681
type: UnificationXref
id: CHEBI:48681
db: ChEBI

ChemicalStructure/PW C001099
type: ChemicalStructure
structure format: SMILES

Compound/PW C041168 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: 2-Hydroxy-6-ketononatrienedioate
stoichiometric coefficient: 1.0

Acetyl-CoA
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Acetyl-CoA
name: SubPathwayInput

Compound/PW C000088 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Fumaric acid
stoichiometric coefficient: 1.0

Compound/PW C040034 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Hydrogen Ion
stoichiometric coefficient: 1.0

trans-Cinnamic acid
type: SmallMoleculeReference
xref: Reference/CAS 621-82-9
xref: Reference/PubChem-compound 444539
xref: Reference/HMDB HMDB0000930
xref: Reference/ChemSpider 392447
xref: Reference/BioCyc CPD-674
xref: Reference/ChEBI CHEBI 35697
xref: Reference/KEGG Compound C00423
chemical formula: C9H8O2
molecular weight: 148.05243
structure: ChemicalStructure/PW C000742

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

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

Reference/PubChem-compound 193669
type: UnificationXref
id: 193669
db: PubChem-compound

Reference/HMDB HMDB0001423
type: UnificationXref
id: HMDB0001423
db: HMDB

2-keto-4-pentenoate hydratase
type: ProteinReference
organism: Klebsiella electrica

2-keto-4-pentenoate hydratase
type: Protein
cellular location: Cytoplasm
entity reference: 2-keto-4-pentenoate hydratase

4-hydroxy-2-oxovalerate aldolase
type: ProteinReference
organism: Klebsiella electrica

2,3-dihydroxyphenylpropionate/2,3-dihydroxicinnamic acid 1,2-dioxygenase
type: ProteinReference
organism: Klebsiella electrica

Acetaldehyde dehydrogenase
type: Protein
cellular location: Cytoplasm
entity reference: Acetaldehyde dehydrogenase

2-hydroxy-6-oxononadienedioate/2-hydroxy-6-oxononatrienedioate hydrolase
type: ProteinReference
organism: Klebsiella electrica

3-phenylpropionate/cinnamic acid dioxygenase ferredoxin--NAD(+) reductase component
type: ProteinReference
organism: Klebsiella electrica

3-phenylpropionate-dihydrodiol/cinnamic acid-dihydrodiol dehydrogenase
type: ProteinReference
organism: Klebsiella electrica

Reference/SMPDB SMP0249043
type: UnificationXref
id: SMP0249043
db: SMPDB

Reference/PathWhiz PW250806
type: UnificationXref
id: PW250806
db: PathWhiz

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

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

Reference/KEGG Compound C00122
type: UnificationXref
id: C00122
db: KEGG Compound

Reference/PathWhiz PW270676
type: UnificationXref
id: PW270676
db: PathWhiz

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

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

Reference/ChemSpider 1031
type: UnificationXref
id: 1031
db: ChemSpider

cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
type: SmallMolecule
cellular location: Cytoplasm
entity reference: cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol

Fumaric acid
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Fumaric acid

Fumaric acid
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000134
xref: Reference/ChemSpider 10197150
xref: Reference/CAS 110-17-8
xref: Reference/PubChem-compound 21883788
xref: Reference/KEGG Compound C00122
xref: Reference/BioCyc FUM
xref: Reference/ChEBI CHEBI 18012
chemical formula: C4H4O4
molecular weight: 116.010956
structure: ChemicalStructure/PW C000088

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

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/BioCyc CPD-674
type: UnificationXref
id: CPD-674
db: BioCyc

Reference/KEGG Compound C00010
type: UnificationXref
id: C00010
db: KEGG Compound

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

Extracellular Space
type: CellularLocationVocabulary
xref: Reference/GENE ONTOLOGY GO 0005615

1.13.11.16
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001065 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C013230 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C041168 Cytoplasm/Stoichiometry/1.0
right: 2-Hydroxy-6-ketononatrienedioate
spontaneous: false
EC number: 1.13.11.16
left: Oxygen
left: (E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid
name: (E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid + Oxygen ↔ 2-Hydroxy-6-ketononatrienedioate
conversion direction: REVERSIBLE

(E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid
type: SmallMolecule
cellular location: Cytoplasm
entity reference: (E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid

Reference/PubChem-compound 444539
type: UnificationXref
id: 444539
db: PubChem-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

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

3.7.1.14
type: BiochemicalReaction
participant stoichiometry: Compound/PW C043300 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C041168 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000088 Cytoplasm/Stoichiometry/1.0
right: Fumaric acid
right: 2-Hydroxy-2,4-pentadienoate
spontaneous: false
EC number: 3.7.1.14
left: Water
left: 2-Hydroxy-6-ketononatrienedioate
name: 2-Hydroxy-6-ketononatrienedioate + Water ↔ 2-Hydroxy-2,4-pentadienoate + Fumaric acid
conversion direction: REVERSIBLE

Reference/HMDB HMDB0001206
type: UnificationXref
id: HMDB0001206
db: HMDB

1.3.1.87
type: BiochemicalReaction
participant stoichiometry: Compound/PW C040034 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C041198 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000721 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C013230 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001144 Cytoplasm/Stoichiometry/1.0
right: Hydrogen Ion
right: (E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid
right: NADH
spontaneous: false
EC number: 1.3.1.87
left: cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
left: NAD
name: NAD + cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol ↔ (E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid + Hydrogen Ion + NADH
conversion direction: REVERSIBLE

Pyruvic acid
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Pyruvic acid

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

2-Hydroxy-2,4-pentadienoate
type: SmallMoleculeReference
xref: Reference/PubChem-compound 5280361
xref: Reference/ChEBI CHEBI 1113
chemical formula: C5H5O3
molecular weight: 113.024414
structure: ChemicalStructure/PW C043300

Reference/KEGG Compound C00022
type: UnificationXref
id: C00022
db: KEGG Compound

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

Reference/HMDB HMDB0032057
type: UnificationXref
id: HMDB0032057
db: HMDB

Reference/KEGG Compound C00024
type: UnificationXref
id: C00024
db: KEGG Compound

Reference/HMDB HMDB0000243
type: UnificationXref
id: HMDB0000243
db: HMDB

4.1.3.39
type: BiochemicalReaction
participant stoichiometry: Compound/PW C040749 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000164 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000784 Cytoplasm/Stoichiometry/1.0
right: Pyruvic acid
right: Acetaldehyde
spontaneous: false
EC number: 4.1.3.39
left: 4-hydroxy-2-oxopentanoate
name: 4-hydroxy-2-oxopentanoate ↔ Acetaldehyde + Pyruvic acid
conversion direction: REVERSIBLE

Reference/GENE ONTOLOGY GO 0005615
type: UnificationXref
id: GO:0005615
db: GENE ONTOLOGY

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

Reaction334119
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001099 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000721 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001144 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000940 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000784 Cytoplasm/Stoichiometry/1.0
right: Hydrogen Ion
right: NADH
right: Acetyl-CoA
spontaneous: false
left: Coenzyme A
left: NAD
left: Acetaldehyde
name: Acetaldehyde + Coenzyme A + NAD ↔ Acetyl-CoA + Hydrogen Ion + NADH
conversion direction: REVERSIBLE

Coenzyme A
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Coenzyme A

2-hydroxy-6-oxononadienedioate/2-hydroxy-6-oxononatrienedioate hydrolase
type: Protein
cellular location: Cytoplasm
entity reference: 2-hydroxy-6-oxononadienedioate/2-hydroxy-6-oxononatrienedioate hydrolase

Klebsiella electrica
type: BioSource
xref: Reference/TAXONOMY 1259973

4.2.1.80
type: BiochemicalReaction
participant stoichiometry: Compound/PW C043300 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040749 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001420 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000088 Cytoplasm/Stoichiometry/1.0
right: Fumaric acid
right: 4-hydroxy-2-oxopentanoate
spontaneous: false
EC number: 4.2.1.80
left: Water
left: 2-Hydroxy-2,4-pentadienoate
name: 2-Hydroxy-2,4-pentadienoate + Water ↔ 4-hydroxy-2-oxopentanoate + Fumaric acid
conversion direction: REVERSIBLE

ReactionCatalysis323460
type: Catalysis
controller: 3-phenylpropionate/cinnamic acid dioxygenase ferredoxin--NAD(+) reductase component
controlled: 1.18.1.3
control type: ACTIVATION

Protein/27197 Cytoplasm/Stoichiometry/2.0
type: Stoichiometry
physical entity: 2-hydroxy-6-oxononadienedioate/2-hydroxy-6-oxononatrienedioate hydrolase
stoichiometric coefficient: 2.0

Compound/PW C041198 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
stoichiometric coefficient: 1.0

Compound/PW C043300 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: 2-Hydroxy-2,4-pentadienoate
stoichiometric coefficient: 1.0

ChemicalStructure/PW C040749
type: ChemicalStructure
structure format: SMILES
structure data: CC(O)CC(=O)C([O-])=O

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

ChemicalStructure/PW C000721
type: ChemicalStructure
structure format: SMILES

Compound/PW C000164 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Pyruvic acid
stoichiometric coefficient: 1.0

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

ChemicalStructure/PW C001144
type: ChemicalStructure
structure format: SMILES

Reference/HMDB HMDB0000134
type: UnificationXref
id: HMDB0000134
db: HMDB

Reference/ChEBI CHEBI 1146900
type: UnificationXref
id: CHEBI:1146900
db: ChEBI

Reference/HMDB HMDB0000930
type: UnificationXref
id: HMDB0000930
db: HMDB

Reference/PubChem-compound 5282147
type: UnificationXref
id: 5282147
db: PubChem-compound

Reference/PubChem-compound 5282145
type: UnificationXref
id: 5282145
db: PubChem-compound

ReactionCatalysis323467
type: Catalysis
controller: 3-phenylpropionate-dihydrodiol/cinnamic acid-dihydrodiol dehydrogenase
controlled: 1.3.1.87
control type: ACTIVATION

Uncharacterized MFS-type transporter electrica_00264
type: Protein
entity reference: Uncharacterized MFS-type transporter electrica_00264

Compound/PW C000784 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Acetaldehyde
stoichiometric coefficient: 1.0

ChemicalStructure/PW C041168
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)C=CC(=O)C=CC=C(O)C(O)=O

Reference/BioCyc CO-A
type: UnificationXref
id: CO-A
db: BioCyc

Reference/CAS 72-89-9
type: UnificationXref
id: 72-89-9
db: CAS

Coenzyme A
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 1146900
xref: Reference/HMDB HMDB0001423
xref: Reference/PubChem-compound 6816
xref: Reference/BioCyc CO-A
xref: Reference/ChemSpider 6557
xref: Reference/CAS 85-61-0
xref: Reference/KEGG Compound C00010
chemical formula: C21H36N7O16P3S
molecular weight: 767.11523
structure: ChemicalStructure/PW C001099

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

Compound/PW C001144 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: NADH
stoichiometric coefficient: 1.0

Compound/PW C000940 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: Acetyl-CoA
stoichiometric coefficient: 1.0

SubPathwayInteraction257013
type: Interaction
name: SubPathway257013Reaction
name: SubPathwayReaction
participant: Acetyl-CoA

Reference/ChemSpider 10197150
type: UnificationXref
id: 10197150
db: ChemSpider

ReactionCatalysis323480
type: Catalysis
controller: 4-hydroxy-2-oxovalerate aldolase
controlled: 4.1.3.39
control type: ACTIVATION

Reference/ChemSpider 6557
type: UnificationXref
id: 6557
db: ChemSpider

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

Compound/PW C000742 Extracellular Space/Stoichiometry/1.0
type: Stoichiometry
physical entity: trans-Cinnamic acid
stoichiometric coefficient: 1.0

ChemicalStructure/PW C000940
type: ChemicalStructure
structure format: SMILES

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

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

Reference/ChEBI CHEBI 18012
type: UnificationXref
id: CHEBI:18012
db: ChEBI

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

Hydrogen Ion
type: SmallMolecule
cellular location: Cytoplasm
entity reference: Hydrogen Ion

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/CAS 127-17-3
type: UnificationXref
id: 127-17-3
db: CAS

ReactionCatalysis323483
type: Catalysis
controller: Acetaldehyde dehydrogenase
controlled: Reaction334119
control type: ACTIVATION

ReactionCatalysis323470
type: Catalysis
controller: 2,3-dihydroxyphenylpropionate/2, 3-dihydroxicinnamic acid 1,2-dioxygenase
controlled: 1.13.11.16
control type: ACTIVATION

ChemicalStructure/PW C013230
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)C=CC1=C(O)C(O)=CC=C1

Trans-cinnamate degradation
type: Pathway
pathway order: PathwayEnzymeReaction/4265655
pathway order: PathwayEnzymeReaction/4265654
pathway order: PathwayEnzymeReaction/4265652
pathway order: PathwaySubPathway/257013
pathway order: PathwayEnzymeReaction/4265656
pathway order: PathwayEnzymeReaction/4265649
pathway order: PathwayEnzymeReaction/4265651
pathway order: PathwayEnzymeReaction/4265650
pathway order: PathwayTransport/4265648
pathway component: ReactionCatalysis323470
pathway component: ReactionCatalysis323460
pathway component: ReactionCatalysis323480
pathway component: Transport23475
pathway component: 1.13.11.16
pathway component: 4.1.3.39
pathway component: Reaction334119
pathway component: 3.7.1.14
pathway component: ReactionCatalysis323467
pathway component: ReactionCatalysis323478
pathway component: TransportCatalysis8080
pathway component: 1.18.1.3
pathway component: 1.3.1.87
pathway component: 4.2.1.80
pathway component: TCA Cycle
pathway component: ReactionCatalysis323483
pathway component: ReactionCatalysis323473
xref: Reference/PathWhiz PW250806
xref: Reference/SMPDB SMP0249043
organism: Klebsiella electrica

Reference/ChemSpider 392447
type: UnificationXref
id: 392447
db: ChemSpider

Reference/TAXONOMY 1259973
type: UnificationXref
id: 1259973
db: TAXONOMY

Compound/PW C000742 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: trans-Cinnamic acid
stoichiometric coefficient: 1.0

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

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

ChemicalStructure/PW C000164
type: ChemicalStructure
structure format: SMILES
structure data: CC(=O)C(O)=O

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

Reference/ChEBI CHEBI 1113
type: UnificationXref
id: CHEBI:1113
db: ChEBI

ReactionCatalysis323478
type: Catalysis
controller: 2-keto-4-pentenoate hydratase
controlled: 4.2.1.80
control type: ACTIVATION

Acetaldehyde
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 15343
xref: Reference/KEGG Compound C00084
xref: Reference/CAS 75-07-0
xref: Reference/BioCyc ACETALD
xref: Reference/ChemSpider 172
xref: Reference/PubChem-compound 177
xref: Reference/HMDB HMDB0000990
chemical formula: C2H4O
molecular weight: 44.026215
structure: ChemicalStructure/PW C000784

ChemicalStructure/PW C041198
type: ChemicalStructure
structure format: SMILES

ReactionCatalysis323473
type: Catalysis
controller: 2-hydroxy-6-oxononadienedioate/2-hydroxy-6-oxononatrienedioate hydrolase
controlled: 3.7.1.14
control type: ACTIVATION

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

trans-Cinnamic acid
type: SmallMolecule
cellular location: Cytoplasm
entity reference: trans-Cinnamic acid

Reference/ChemSpider 392413
type: UnificationXref
id: 392413
db: ChemSpider

Reference/KEGG Compound C03589
type: UnificationXref
id: C03589
db: KEGG Compound

2,3-dihydroxyphenylpropionate/2, 3-dihydroxicinnamic acid 1,2-dioxygenase
type: Complex
component stoichiometry: Protein/27196 Cytoplasm/Stoichiometry/4.0
cellular location: Cytoplasm
component: 2,3-dihydroxyphenylpropionate/2,3-dihydroxicinnamic acid 1,2-dioxygenase

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

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

Reference/SMPDB SMP0268882
type: UnificationXref
id: SMP0268882
db: SMPDB

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

Reference/KEGG Compound C00084
type: UnificationXref
id: C00084
db: KEGG Compound

Reference/CAS 75-07-0
type: UnificationXref
id: 75-07-0
db: CAS

Reference/ChemSpider 172
type: UnificationXref
id: 172
db: ChemSpider

2-Hydroxy-6-ketononatrienedioate
type: SmallMolecule
cellular location: Cytoplasm
entity reference: 2-Hydroxy-6-ketononatrienedioate

ChemicalStructure/PW C043300
type: ChemicalStructure
structure format: SMILES
structure data: [H]C(C=C)=C(O)C([O-])=O

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

Reference/ChEBI CHEBI 32816
type: UnificationXref
id: CHEBI:32816
db: ChEBI

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/BioCyc PYRUVATE
type: UnificationXref
id: PYRUVATE
db: BioCyc

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

2-hydroxy-6-oxononadienedioate/2-hydroxy-6-oxononatrienedioate hydrolase
type: Complex
component stoichiometry: Protein/27197 Cytoplasm/Stoichiometry/2.0
cellular location: Cytoplasm
component: 2-hydroxy-6-oxononadienedioate/2-hydroxy-6-oxononatrienedioate hydrolase

Uncharacterized MFS-type transporter electrica_00264
type: ProteinReference

Reference/KEGG Compound C12623
type: UnificationXref
id: C12623
db: KEGG Compound

ChemicalStructure/PW C000784
type: ChemicalStructure
structure format: SMILES
structure data: CC=O

4-hydroxy-2-oxovalerate aldolase
type: Protein
cellular location: Cytoplasm
entity reference: 4-hydroxy-2-oxovalerate aldolase

1.18.1.3
type: BiochemicalReaction
participant stoichiometry: Compound/PW C040034 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001065 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C041198 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000721 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001144 Cytoplasm/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000742 Cytoplasm/Stoichiometry/1.0
right: cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
right: NAD
spontaneous: false
EC number: 1.18.1.3
left: Oxygen
left: trans-Cinnamic acid
left: Hydrogen Ion
left: NADH
name: Hydrogen Ion + NADH + Oxygen + trans-Cinnamic acid ↔ NAD + cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
conversion direction: REVERSIBLE

cis-3-(3-Carboxyethenyl)-3,5-cyclohexadiene-1,2-diol
type: SmallMoleculeReference
xref: Reference/PubChem-compound 5282145
chemical formula: C9H10O4
molecular weight: 182.0579
structure: ChemicalStructure/PW C041198

Reference/ChEBI CHEBI 15343
type: UnificationXref
id: CHEBI:15343
db: ChEBI

Reference/PubChem-compound 444493
type: UnificationXref
id: 444493
db: PubChem-compound

Compound/PW C000721 Cytoplasm/Stoichiometry/1.0
type: Stoichiometry
physical entity: NAD
stoichiometric coefficient: 1.0

ChemicalStructure/PW C000742
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)\C=C\C1=CC=CC=C1

Protein/27196 Cytoplasm/Stoichiometry/4.0
type: Stoichiometry
physical entity: 2,3-dihydroxyphenylpropionate/2,3-dihydroxicinnamic acid 1,2-dioxygenase
stoichiometric coefficient: 4.0

Reference/BioCyc ACETYL-COA
type: UnificationXref
id: ACETYL-COA
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

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

Reference/HMDB HMDB0000990
type: UnificationXref
id: HMDB0000990
db: HMDB

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

Reference/PubChem-compound 1060
type: UnificationXref
id: 1060
db: PubChem-compound

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

Reference/CAS 31082-90-3
type: UnificationXref
id: 31082-90-3
db: CAS

Transport23475
type: Transport
participant stoichiometry: Compound/PW C000742 Extracellular Space/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000742 Cytoplasm/Stoichiometry/1.0
right: trans-Cinnamic acid
spontaneous: true
left: trans-Cinnamic acid
name: trans-Cinnamic acid (→) Transport: Klebsiella electrica , Cell, Extracellular Space to Klebsiella electrica , Cell, Cytoplasm
conversion direction: REVERSIBLE

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

Reference/KEGG Compound C00423
type: UnificationXref
id: C00423
db: KEGG Compound

Reference/PubChem-compound 177
type: UnificationXref
id: 177
db: PubChem-compound

Reference/ChEBI CHEBI 15351
type: UnificationXref
id: CHEBI:15351
db: ChEBI

ChemicalStructure/PW C000088
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)\C=C\C(O)=O

Reference/CAS 85-61-0
type: UnificationXref
id: 85-61-0
db: CAS

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