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🧪 Cyclohex-1,5-diene-1-carboxyl-CoA

Appears in: 1 pathway
Produces: 1 compound
Produced by: 3 transformations

Chemical Structure

Cyclohex-1,5-diene-1-carboxyl-CoA

📋 Properties

SMILES:
O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(N2C=NC=3C(=NC=NC32)N)C(O)C1OP(=O)(O)O)C=4C=CCCC4
InChI:
InChI=1S/C28H42N7O17P3S/c1-28(2,22(38)25(39)31-9-8-18(36)30-10-11-56-27(40)16-6-4-3-5-7-16)13-49-55(46,47)52-54(44,45)48-12-17-21(51-53(41,42)43)20(37)26(50-17)35-15-34-19-23(29)32-14-33-24(19)35/h4,6-7,14-15,17,20-22,26,37-38H,3,5,8-13H2,1-2H3,(H,30,36)(H,31,39)(H,44,45)(H,46,47)(H2,29,32,33)(H2,41,42,43)
Database ID:
838
External:
View on PubChem ↗

🔬 Reactant

Reactant Cyclohex-1,5-diene-1-carboxyl-CoA → Product 6-Hydroxycyclohex-1-ene-1-carboxyl-CoA
dienoyl-CoA hydratase (Eawag BBD reaction r0203)       (EC 4.2.1.100)
In pathway: Benzoate (anaerobic)

🔬 Product

Reactant Cyclohex-1,4-diene-1-carboxyl-CoA → Product Cyclohex-1,5-diene-1-carboxyl-CoA
Eawag BBD reaction r0507
In pathway: Benzoate (anaerobic)
Reactant Cyclohex-2,5-diene-1-carboxyl-CoA → Product Cyclohex-1,5-diene-1-carboxyl-CoA
Eawag BBD reaction r0506
In pathway: Benzoate (anaerobic)
Reactant Benzoyl-CoA → Product Cyclohex-1,5-diene-1-carboxyl-CoA
benzoyl-CoA reductase (Eawag BBD reaction r0190)       (EC 1.3.7.8)
In pathway: Benzoate (anaerobic)

🗺️ All Pathways Containing This Compound

Benzoate (anaerobic)
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