← Back to Compounds

🧪 6-Oxo-2-hydroxy-7-(4`-chlorophenyl)-3,8,8-trichloroocta-2Z,4Z,7-trienoate

Appears in: 1 pathway
Produces: 2 compounds
Produced by: 1 transformation

Chemical Structure

6-Oxo-2-hydroxy-7-(4`-chlorophenyl)-3,8,8-trichloroocta-2Z,4Z,7-trienoate

📋 Properties

SMILES:
O=C([O-])C(O)=C(Cl)C=CC(=O)C(=C(Cl)Cl)C1=CC=C(Cl)C=C1
InChI:
InChI=1S/C14H8Cl4O4/c15-8-3-1-7(2-4-8)11(13(17)18)10(19)6-5-9(16)12(20)14(21)22/h1-6,20H,(H,21,22)/p-1/b6-5-,12-9-
Database ID:
673
External:
View on PubChem ↗

🔬 Reactant

Reactant 6-Oxo-2-hydroxy-7-(4`-chlorophenyl)-3,8,8-trichloroocta-2Z,4Z,7-trienoate → Product cis-2-Hydroxy-3-chloropenta-2,4-dienone
6-oxo-2-hydroxy-7-(4`-chlorophenyl)-3,8,8-trichloroocta-2E,4E,7-trienoate hydrolase (Eawag BBD reaction r0444)       (EC 3.7.1.-)
In pathway: 1,1,1-Trichloro-2,2-bis-(4`-chlorophenyl)ethane (DDT)
Reactant 6-Oxo-2-hydroxy-7-(4`-chlorophenyl)-3,8,8-trichloroocta-2Z,4Z,7-trienoate → Product 2-(4`-Chlorophenyl)-3,3-dichloropropenoate
6-oxo-2-hydroxy-7-(4`-chlorophenyl)-3,8,8-trichloroocta-2E,4E,7-trienoate hydrolase (Eawag BBD reaction r0444)       (EC 3.7.1.-)
In pathway: 1,1,1-Trichloro-2,2-bis-(4`-chlorophenyl)ethane (DDT)

🔬 Product

Reactant 1,1-Dichloro-2-(dihydroxy-4`-chorophenyl)-2-(4`-chlorophenyl)ethylene → Product 6-Oxo-2-hydroxy-7-(4`-chlorophenyl)-3,8,8-trichloroocta-2Z,4Z,7-trienoate
1,1-dichloro-2-(dihydroxy-4-chlorophenyl)-(4-chlorophenyl)ethylene 1,2-dioxygenase (Eawag BBD reaction r0442)       (EC 1.13.11.-)
In pathway: 1,1,1-Trichloro-2,2-bis-(4`-chlorophenyl)ethane (DDT)

🗺️ All Pathways Containing This Compound

1,1,1-Trichloro-2,2-bis-(4`-chlorophenyl)ethane (DDT)
← Back to Compounds