Oxalacetic acid
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000223
xref: Reference/CAS 328-42-7
xref: Reference/ChEBI CHEBI 30744
xref: Reference/BioCyc OXALACETIC ACID
xref: Reference/ChemSpider 945
xref: Reference/PubChem-compound 970
xref: Reference/KEGG Compound C00036
chemical formula: C4H4O5
molecular weight: 132.00587
structure: ChemicalStructure/PW C000148

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

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

Reference/KEGG Compound C00311
type: UnificationXref
id: C00311
db: KEGG Compound

Succinic acid
type: SmallMolecule
entity reference: Succinic acid

Reference/ChEBI CHEBI 30797
type: UnificationXref
id: CHEBI:30797
db: ChEBI

NADH
type: SmallMolecule
entity reference: NADH

direct_interaction
type: InteractionVocabulary

cis-Aconitic acid
type: SmallMolecule
entity reference: cis-Aconitic acid

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

Compound/PW C000125/Stoichiometry/1.0
type: Stoichiometry
physical entity: Isocitric acid
stoichiometric coefficient: 1.0

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

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

Acinetobacter haemolyticus NIPH 261
type: BioSource
xref: Reference/TAXONOMY 1217986

Reference/HMDB HMDB0000094
type: UnificationXref
id: HMDB0000094
db: HMDB

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

Unknown
type: Protein
entity reference: Unknown

NAD
type: SmallMolecule
entity reference: NAD

Reference/BioCyc OXALACETIC ACID
type: UnificationXref
id: OXALACETIC_ACID
db: BioCyc

Compound/PW C000101/Stoichiometry/1.0
type: Stoichiometry
physical entity: L-Malic acid
stoichiometric coefficient: 1.0

Reference/CAS 328-42-7
type: UnificationXref
id: 328-42-7
db: CAS

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

ChemicalStructure/PW C000101
type: ChemicalStructure
structure format: SMILES
structure data: O[C@@H](CC(O)=O)C(O)=O

Reference/ChemSpider 44
type: UnificationXref
id: 44
db: ChemSpider

Secondary Metabolites: Glyoxylate Cycle
type: Pathway
pathway order: PathwayEnzymeReaction/6608493
pathway order: PathwayEnzymeReaction/6608486
pathway order: PathwayEnzymeReaction/6608497
pathway order: PathwayInteraction/8469
pathway order: PathwayEnzymeReaction/6608500
pathway order: PathwayEnzymeReaction/6608479
pathway order: PathwayEnzymeReaction/6608502
pathway order: PathwaySubPathway/490683
pathway order: PathwayEnzymeReaction/6608480
pathway order: PathwayEnzymeReaction/6608481
pathway component: Endocytosis
pathway component: 4.2.1.3
pathway component: Interaction8469
pathway component: ReactionCatalysis1126833
pathway component: ReactionCatalysis1126844
pathway component: ReactionCatalysis1126846
pathway component: 4.1.3.1
pathway component: ReactionCatalysis1126848
pathway component: 2.3.3.9
pathway component: ReactionCatalysis1126828
pathway component: ReactionCatalysis1126827
pathway component: ReactionCatalysis1126838
pathway component: Reaction1102421
pathway component: 1.1.1.37
pathway component: Reaction5164
xref: Reference/SMPDB SMP0449573
xref: Reference/PathWhiz PW466648
organism: Acinetobacter haemolyticus NIPH 261

Reaction5164
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000051/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000765/Stoichiometry/1.0
right: trans-Aconitic acid
spontaneous: true
left: cis-Aconitic acid
name: cis-Aconitic acid → trans-Aconitic acid
conversion direction: LEFT_TO_RIGHT

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

malate dehydrogenase
type: Complex
component stoichiometry: Protein/29263/Stoichiometry/2.0
component: Unknown

isocitrate lyase
type: Complex
component stoichiometry: Protein/29263/Stoichiometry/4.0
component: Unknown

Isocitric acid
type: SmallMoleculeReference
xref: Reference/CAS 320-77-4
xref: Reference/BioCyc threo-d(s)-iso-citrate
xref: Reference/ChEBI CHEBI 30887
xref: Reference/ChemSpider 1161
xref: Reference/HMDB HMDB0000193
xref: Reference/KEGG Compound C00311
xref: Reference/PubChem-compound 1198
chemical formula: C6H8O7
molecular weight: 192.02701
structure: ChemicalStructure/PW C000125

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

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

Protein/29263/Stoichiometry/2.0
type: Stoichiometry
physical entity: Unknown
stoichiometric coefficient: 2.0

Reference/CAS 97-67-6
type: UnificationXref
id: 97-67-6
db: CAS

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

Citrate hydro-lyase (cis-aconitate-forming)
type: Complex
component stoichiometry: Protein/29263/Stoichiometry/2.0
component: Unknown

Citrate hydro-lyase
type: Complex
component stoichiometry: Protein/29263/Stoichiometry/2.0
component: Unknown

citrate synthase
type: Complex
component stoichiometry: Protein/29263/Stoichiometry/6.0
component: Unknown

Oxalacetic acid
type: SmallMolecule
entity reference: Oxalacetic acid

Acetyl-CoA
type: SmallMolecule
entity reference: Acetyl-CoA
name: SubPathwayOutput

Reference/ChemSpider 945
type: UnificationXref
id: 945
db: ChemSpider

Reference/CAS 77-92-9
type: UnificationXref
id: 77-92-9
db: CAS

Reference/ChemSpider 558863
type: UnificationXref
id: 558863
db: ChemSpider

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

ChemicalStructure/PW C001099
type: ChemicalStructure
structure format: SMILES

Reference/ChEBI CHEBI 30769
type: UnificationXref
id: CHEBI:30769
db: ChEBI

Compound/PW C000765/Stoichiometry/1.0
type: Stoichiometry
physical entity: trans-Aconitic acid
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 30887
type: UnificationXref
id: CHEBI:30887
db: ChEBI

Reference/PubChem-compound 643757
type: UnificationXref
id: 643757
db: PubChem-compound

Hydrogen Ion
type: SmallMolecule
entity reference: Hydrogen Ion

Reference/ChemSpider 1161
type: UnificationXref
id: 1161
db: ChemSpider

4.2.1.3
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000063/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000051/Stoichiometry/1.0
right: Water
right: cis-Aconitic acid
spontaneous: false
EC number: 4.2.1.3
left: Citric acid
name: Citric acid → Water + cis-Aconitic acid
conversion direction: LEFT_TO_RIGHT

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

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

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

Glyoxylic acid
type: SmallMoleculeReference
xref: Reference/BioCyc GLYOX
xref: Reference/ChemSpider 740
xref: Reference/CAS 298-12-4
xref: Reference/HMDB HMDB0000119
xref: Reference/PubChem-compound 760
xref: Reference/ChEBI CHEBI 16891
xref: Reference/KEGG Compound C00048
chemical formula: C2H2O3
molecular weight: 74.0004
structure: ChemicalStructure/PW C000075

Reference/SMPDB SMP0449573
type: UnificationXref
id: SMP0449573
db: SMPDB

Reference/BioCyc CPD-225
type: UnificationXref
id: CPD-225
db: BioCyc

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

trans-Aconitic acid
type: SmallMolecule
entity reference: trans-Aconitic acid

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

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

Reference/HMDB HMDB0000223
type: UnificationXref
id: HMDB0000223
db: HMDB

Unknown
type: ProteinReference

Reference/ChEBI CHEBI 15741
type: UnificationXref
id: CHEBI:15741
db: ChEBI

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

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

ReactionCatalysis1126833
type: Catalysis
controller: citrate synthase
controlled: Reaction1102421
control type: ACTIVATION

Reference/PubChem-compound 1110
type: UnificationXref
id: 1110
db: PubChem-compound

Glyoxylic acid
type: SmallMolecule
entity reference: Glyoxylic acid

Compound/PW C000063/Stoichiometry/1.0
type: Stoichiometry
physical entity: Citric acid
stoichiometric coefficient: 1.0

ReactionCatalysis1126828
type: Catalysis
controller: Citrate hydro-lyase (cis-aconitate-forming)
controlled: 4.2.1.3
control type: ACTIVATION

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

ReactionCatalysis1126827
type: Catalysis
controller: Citrate hydro-lyase
controlled: 4.2.1.3
control type: ACTIVATION

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

Succinic acid
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000254
xref: Reference/CAS 110-15-6
xref: Reference/ChEBI CHEBI 15741
xref: Reference/KEGG Compound C00042
xref: Reference/ChemSpider 1078
xref: Reference/PubChem-compound 1110
xref: Reference/BioCyc SUC
chemical formula: C4H6O4
molecular weight: 118.02661
structure: ChemicalStructure/PW C000174

Reference/PubChem-compound 45
type: UnificationXref
id: 45
db: PubChem-compound

cis-Aconitic acid
type: SmallMoleculeReference
xref: Reference/PubChem-compound 643757
xref: Reference/KEGG Compound C00417
xref: Reference/HMDB HMDB0000072
xref: Reference/ChEBI CHEBI 32805
xref: Reference/BioCyc CIS-ACONITATE
xref: Reference/ChemSpider 558863
xref: Reference/CAS 585-84-2
chemical formula: C6H6O6
molecular weight: 174.01643
structure: ChemicalStructure/PW C000051

Reference/CAS 320-77-4
type: UnificationXref
id: 320-77-4
db: CAS

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/BioCyc threo-d(s)-iso-citrate
type: UnificationXref
id: threo-d(s)-iso-citrate
db: BioCyc

Reference/KEGG Compound C00149
type: UnificationXref
id: C00149
db: KEGG Compound

Reference/HMDB HMDB0000119
type: UnificationXref
id: HMDB0000119
db: HMDB

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

ReactionCatalysis1126844
type: Catalysis
controller: malate dehydrogenase
controlled: 1.1.1.37
control type: ACTIVATION

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

Citric acid
type: SmallMolecule
entity reference: Citric acid

ChemicalStructure/PW C000125
type: ChemicalStructure
structure format: SMILES
structure data: OC(C(CC(O)=O)C(O)=O)C(O)=O

ReactionCatalysis1126838
type: Catalysis
controller: Unknown
controlled: 4.2.1.3
control type: ACTIVATION

Reference/CAS 298-12-4
type: UnificationXref
id: 298-12-4
db: CAS

Citric acid
type: SmallMoleculeReference
xref: Reference/ChEBI CHEBI 30769
xref: Reference/BioCyc CIT
xref: Reference/HMDB HMDB0000094
xref: Reference/PubChem-compound 19782904
xref: Reference/KEGG Compound C00158
xref: Reference/CAS 77-92-9
xref: Reference/ChemSpider 305
chemical formula: C6H8O7
molecular weight: 192.02701
structure: ChemicalStructure/PW C000063

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

ChemicalStructure/PW C000721
type: ChemicalStructure
structure format: SMILES

Reference/PubChem-compound 19782904
type: UnificationXref
id: 19782904
db: PubChem-compound

Reference/PubChem-compound 760
type: UnificationXref
id: 760
db: PubChem-compound

Reference/ChEBI CHEBI 16891
type: UnificationXref
id: CHEBI:16891
db: ChEBI

Reference/KEGG Compound C00158
type: UnificationXref
id: C00158
db: KEGG Compound

Reference/KEGG Compound C00036
type: UnificationXref
id: C00036
db: KEGG Compound

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

ChemicalStructure/PW C001144
type: ChemicalStructure
structure format: SMILES

ReactionCatalysis1126846
type: Catalysis
controller: isocitrate lyase
controlled: 4.1.3.1
control type: ACTIVATION

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

Reference/HMDB HMDB0000254
type: UnificationXref
id: HMDB0000254
db: HMDB

Reference/CAS 80-69-3
type: UnificationXref
id: 80-69-3
db: CAS

Water
type: SmallMolecule
entity reference: Water

ChemicalStructure/PW C000174
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)CCC(O)=O

ReactionCatalysis1126848
type: Catalysis
controller: Unknown
controlled: 2.3.3.9
control type: ACTIVATION

ChemicalStructure/PW C000051
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)C\C(=C\C(O)=O)C(O)=O

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

Reference/HMDB HMDB0035227
type: UnificationXref
id: HMDB0035227
db: HMDB

Endocytosis
type: Pathway
pathway order: SubPathwayInteractionSteps/SubPathway490683
pathway component: SubPathwayInteraction490683
name: SubPathway

Reference/PubChem-compound 222656
type: UnificationXref
id: 222656
db: PubChem-compound

Reference/KEGG Compound C00042
type: UnificationXref
id: C00042
db: KEGG Compound

Reference/KEGG Compound C02341
type: UnificationXref
id: C02341
db: KEGG Compound

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

Reference/ChemSpider 1078
type: UnificationXref
id: 1078
db: ChemSpider

Reference/KEGG Compound C00048
type: UnificationXref
id: C00048
db: KEGG Compound

Interaction8469
type: MolecularInteraction
interaction type: direct_interaction
name: Hydroxypropanedioic acid inhibits isocitrate lyase
participant: isocitrate lyase
participant: Hydroxypropanedioic acid

Coenzyme A
type: SmallMolecule
entity reference: Coenzyme A

ChemicalStructure/PW C000063
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)CC(O)(CC(O)=O)C(O)=O

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

Reference/CAS 4023-65-8
type: UnificationXref
id: 4023-65-8
db: CAS

trans-Aconitic acid
type: SmallMoleculeReference
xref: Reference/BioCyc CPD-225
xref: Reference/CAS 4023-65-8
xref: Reference/ChemSpider 392201
xref: Reference/HMDB HMDB0000958
xref: Reference/PubChem-compound 444212
xref: Reference/KEGG Compound C02341
xref: Reference/ChEBI CHEBI 32806
chemical formula: C6H6O6
molecular weight: 174.01643
structure: ChemicalStructure/PW C000765

Reference/ChEBI CHEBI 16513
type: UnificationXref
id: CHEBI:16513
db: ChEBI

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

Protein/29263/Stoichiometry/6.0
type: Stoichiometry
physical entity: Unknown
stoichiometric coefficient: 6.0

Reference/PubChem-compound 444212
type: UnificationXref
id: 444212
db: PubChem-compound

ChemicalStructure/PW C000148
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)CC(=O)C(O)=O

ChemicalStructure/PW C000940
type: ChemicalStructure
structure format: SMILES

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

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

Reference/HMDB HMDB0000156
type: UnificationXref
id: HMDB0000156
db: HMDB

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

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

4.1.3.1
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000125/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000075/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000174/Stoichiometry/1.0
right: Succinic acid
right: Glyoxylic acid
spontaneous: false
EC number: 4.1.3.1
left: Isocitric acid
name: Isocitric acid ↔ Glyoxylic acid + Succinic acid
conversion direction: REVERSIBLE

2.3.3.9
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001099/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000075/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000940/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000101/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Coenzyme A
right: L-Malic acid
right: Hydrogen Ion
spontaneous: false
EC number: 2.3.3.9
left: Glyoxylic acid
left: Water
left: Acetyl-CoA
name: Acetyl-CoA + Glyoxylic acid + Water → Coenzyme A + Hydrogen Ion + L-Malic acid
conversion direction: LEFT_TO_RIGHT

1.1.1.37
type: BiochemicalReaction
participant stoichiometry: Compound/PW C000721/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000101/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001144/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000148/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: NADH
right: Hydrogen Ion
right: Oxalacetic acid
spontaneous: false
EC number: 1.1.1.37
left: L-Malic acid
left: NAD
name: L-Malic acid + NAD → Hydrogen Ion + NADH + Oxalacetic acid
conversion direction: LEFT_TO_RIGHT

Hydroxypropanedioic acid
type: SmallMoleculeReference
xref: Reference/CAS 80-69-3
xref: Reference/ChEBI CHEBI 16513
xref: Reference/ChemSpider 44
xref: Reference/HMDB HMDB0035227
xref: Reference/KEGG Compound C02287
xref: Reference/PubChem-compound 45
chemical formula: C3H4O5
molecular weight: 120.005875
structure: ChemicalStructure/PW C016201

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

Reference/HMDB HMDB0000958
type: UnificationXref
id: HMDB0000958
db: HMDB

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

Reference/ChemSpider 305
type: UnificationXref
id: 305
db: ChemSpider

4.2.1.3
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000051/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000125/Stoichiometry/1.0
right: Isocitric acid
spontaneous: false
EC number: 4.2.1.3
left: Water
left: cis-Aconitic acid
name: Water + cis-Aconitic acid ↔ Isocitric acid
conversion direction: REVERSIBLE

Reaction1102421
type: BiochemicalReaction
participant stoichiometry: Compound/PW C001420/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000063/Stoichiometry/1.0
participant stoichiometry: Compound/PW C001099/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000940/Stoichiometry/1.0
participant stoichiometry: Compound/PW C000148/Stoichiometry/1.0
participant stoichiometry: Compound/PW C040034/Stoichiometry/1.0
right: Coenzyme A
right: Citric acid
right: Hydrogen Ion
spontaneous: false
left: Water
left: Oxalacetic acid
left: Acetyl-CoA
name: Acetyl-CoA + Oxalacetic acid + Water → Citric acid + Coenzyme A + Hydrogen Ion
conversion direction: LEFT_TO_RIGHT

Reference/ChemSpider 392201
type: UnificationXref
id: 392201
db: ChemSpider

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

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

Hydroxypropanedioic acid
type: SmallMolecule
entity reference: Hydroxypropanedioic acid

Compound/PW C000174/Stoichiometry/1.0
type: Stoichiometry
physical entity: Succinic acid
stoichiometric coefficient: 1.0

ChemicalStructure/PW C000765
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)C\C(=C/C(O)=O)C(O)=O

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

Reference/TAXONOMY 1217986
type: UnificationXref
id: 1217986
db: TAXONOMY

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

Reference/CAS 110-15-6
type: UnificationXref
id: 110-15-6
db: CAS

SubPathwayInteraction490683
type: Interaction
name: SubPathwayReaction
name: SubPathway490683Reaction
participant: Acetyl-CoA

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

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

ChemicalStructure/PW C016201
type: ChemicalStructure
structure format: SMILES
structure data: OC(C(O)=O)C(O)=O

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

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

Isocitric acid
type: SmallMolecule
entity reference: Isocitric acid

Reference/CAS 585-84-2
type: UnificationXref
id: 585-84-2
db: CAS

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

Reference/ChEBI CHEBI 30744
type: UnificationXref
id: CHEBI:30744
db: ChEBI

Compound/PW C000075/Stoichiometry/1.0
type: Stoichiometry
physical entity: Glyoxylic acid
stoichiometric coefficient: 1.0

Reference/ChEBI CHEBI 32805
type: UnificationXref
id: CHEBI:32805
db: ChEBI

Reference/ChEBI CHEBI 32806
type: UnificationXref
id: CHEBI:32806
db: ChEBI

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

Reference/KEGG Compound C00417
type: UnificationXref
id: C00417
db: KEGG Compound

Reference/PubChem-compound 1198
type: UnificationXref
id: 1198
db: PubChem-compound

ChemicalStructure/PW C000075
type: ChemicalStructure
structure format: SMILES
structure data: OC(=O)C=O

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

Protein/29263/Stoichiometry/4.0
type: Stoichiometry
physical entity: Unknown
stoichiometric coefficient: 4.0

Reference/PathWhiz PW466648
type: UnificationXref
id: PW466648
db: PathWhiz

Reference/ChemSpider 193317
type: UnificationXref
id: 193317
db: ChemSpider

Reference/HMDB HMDB0000072
type: UnificationXref
id: HMDB0000072
db: HMDB

Reference/HMDB HMDB0000193
type: UnificationXref
id: HMDB0000193
db: HMDB

Compound/PW C000148/Stoichiometry/1.0
type: Stoichiometry
physical entity: Oxalacetic acid
stoichiometric coefficient: 1.0

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

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

Compound/PW C000051/Stoichiometry/1.0
type: Stoichiometry
physical entity: cis-Aconitic acid
stoichiometric coefficient: 1.0

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

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

Reference/BioCyc CIS-ACONITATE
type: UnificationXref
id: CIS-ACONITATE
db: BioCyc

Reference/PubChem-compound 970
type: UnificationXref
id: 970
db: PubChem-compound

Reference/KEGG Compound C02287
type: UnificationXref
id: C02287
db: KEGG Compound

Reference/ChemSpider 740
type: UnificationXref
id: 740
db: ChemSpider

L-Malic acid
type: SmallMolecule
entity reference: L-Malic acid

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

L-Malic acid
type: SmallMoleculeReference
xref: Reference/HMDB HMDB0000156
xref: Reference/ChEBI CHEBI 30797
xref: Reference/KEGG Compound C00149
xref: Reference/ChemSpider 193317
xref: Reference/PubChem-compound 222656
xref: Reference/CAS 97-67-6
chemical formula: C4H6O5
molecular weight: 134.02153
structure: ChemicalStructure/PW C000101