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🧪 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA

Appears in: 1 pathway
Produces: 1 compound
Produced by: 2 transformations

Chemical Structure

3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-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(C)C(O)CC(=C)C(C)C
InChI:
InChI=1S/C31H52N7O18P3S/c1-16(2)17(3)11-19(39)18(4)30(44)60-10-9-33-21(40)7-8-34-28(43)25(42)31(5,6)13-53-59(50,51)56-58(48,49)52-12-20-24(55-57(45,46)47)23(41)29(54-20)38-15-37-22-26(32)35-14-36-27(22)38/h14-16,18-20,23-25,29,39,41-42H,3,7-13H2,1-2,4-6H3,(H,33,40)(H,34,43)(H,48,49)(H,50,51)(H2,32,35,36)(H2,45,46,47)
Database ID:
447
External:
View on PubChem ↗

🔬 Reactant

Reactant 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA → Product 2,6-Dimethyl-5-methylene-3-oxo-heptanoyl-CoA
3-hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA dehydrogenase (Eawag BBD reaction r0986)       (EC 1.1.-.-)
In pathway: alpha-Pinene

🔬 Product

Reactant cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA → Product 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA
enoyl-CoA hydratase (Eawag BBD reaction r0990)       (EC 4.2.1.17)
In pathway: alpha-Pinene
Reactant trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA → Product 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA
enoyl-CoA hydratase (Eawag BBD reaction r0992)       (EC 4.2.1.17)
In pathway: alpha-Pinene

🗺️ All Pathways Containing This Compound

alpha-Pinene
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