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🧪 cis-4-(8-Hydroxypyren-7-yl)-2-oxobut-3-enoate

Appears in: 1 pathway
Produces: 3 compounds
Produced by: 1 transformation

Chemical Structure

cis-4-(8-Hydroxypyren-7-yl)-2-oxobut-3-enoate

📋 Properties

SMILES:
O=C([O-])C(=O)C=CC=1C=C2C=CC3=CC=CC=4C=CC(C1O)=C2C34
InChI:
InChI=1S/C20H12O4/c21-16(20(23)24)9-7-14-10-13-5-4-11-2-1-3-12-6-8-15(19(14)22)18(13)17(11)12/h1-10,22H,(H,23,24)/p-1/b9-7-
Database ID:
1333
External:
View on PubChem ↗

🔬 Reactant

Reactant cis-4-(8-Hydroxypyren-7-yl)-2-oxobut-3-enoate → Product 10-Oxabenzo(def)chrysen-9-one
cis-4-(8-hydroxypyren-7-yl)-2-oxobut-3-enoate lyase (Eawag BBD reaction r1135)       (EC 4.1.3.-)
In pathway: Benzo[a]pyrene
Reactant cis-4-(8-Hydroxypyren-7-yl)-2-oxobut-3-enoate → Product Pyruvate
Eawag BBD reaction r1136
In pathway: Benzo[a]pyrene
Reactant cis-4-(8-Hydroxypyren-7-yl)-2-oxobut-3-enoate → Product 7,8-Dihydropyrene-7-carboxylate
Eawag BBD reaction r1136
In pathway: Benzo[a]pyrene

🔬 Product

Reactant 9,10-Dihydroxybenzo(a)pyrene → Product cis-4-(8-Hydroxypyren-7-yl)-2-oxobut-3-enoate
9,10-dihydroxybenzo(a)pyrene dioxygenase (Eawag BBD reaction r1134)       (EC 1.13.11.-)
In pathway: Benzo[a]pyrene

🗺️ All Pathways Containing This Compound

Benzo[a]pyrene
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