For research use only. Not for therapeutic Use.
Isohumulone(CAT: M000854) is a key bitter compound found in hops, playing a crucial role in the flavor profile of beer. It is one of the primary iso-alpha acids that give beer its characteristic bitterness. Isohumulone is formed during the brewing process when humulone, a naturally occurring alpha acid in hops, undergoes isomerization under heat. This compound not only contributes to the bitterness but also to the stability and preservation of beer. Additionally, isohumulone has been studied for its potential health benefits, including anti-inflammatory and antimicrobial properties, making it an interesting subject for research in both brewing and medical fields.
Catalog Number | M000854 |
CAS Number | 25522-96-7 |
Synonyms | Isohumulone; 3,4-dihydroxy-5-(3-methylbut-2-enyl)-2-(3-methyl-1-oxobutyl)-4-(4-methyl-1-oxopent-3-enyl)cyclopent-2-en-1-one;2-(1-Oxo-3-methylbutyl)-3,4-dihydroxy-4-(1-oxo-4-methyl-3-pentenyl)-5-prenyl-2-cyclopentene-1-one;2-(3-Methylbutanoyl)-3,4-dih |
Molecular Formula | C21H30O5 |
Purity | ≥95% |
Storage | RT |
IUPAC Name | 3,4-dihydroxy-2-(3-methylbutanoyl)-5-(3-methylbut-2-enyl)-4-(4-methylpent-3-enoyl)cyclopent-2-en-1-one |
InChI | InChI=1S/C21H30O5/c1-12(2)7-9-15-19(24)18(16(22)11-14(5)6)20(25)21(15,26)17(23)10-8-13(3)4/h7-8,14-15,25-26H,9-11H2,1-6H3 |
InChIKey | QARXXMMQVDCYGZ-UHFFFAOYSA-N |
SMILES | CC(C)CC(=O)C1=C(C(C(C1=O)CC=C(C)C)(C(=O)CC=C(C)C)O)O |