Isoadhumulone

3,4-dihydroxy-2-(2-methylbutanoyl)-5-(3-methylbut-2-enyl)-4-(4-methylpent-3-enoyl)cyclopent-2-en-1-one

Also Known As: Isoadhumulone|iso-adhumulone|trans-Isoadhumulone|EINECS 246-967-4|3,4-dihydroxy-5-2-4- cyclopent-2-en-1-one|3,4-dihydroxy-5- -2- -4- cyclopent-2-en-1-one|3,4-dihydroxy-2-(2-methylbutanoyl)-5-(3-methylbut-2-enyl)-4-(4-methylpent-3-enoyl)cyclopent-2-en-1-one|3,4-Dihydroxy-5-(3-methylbut-2-enyl)-2-(2-methyl-1-oxobutyl)-4-(4-methyl-1-oxopent-3-enyl)cyclopent-2-en-1-one|3,4-dihydroxy-2-(2-methylbutanoyl)-5-(3-methylbut-2-en-1-yl)-4-(4-methylpent-3-enoyl)cyclopent-2-en-1-one|2-(2-Methylbutanoyl)-3,4-dihydroxy-4-(4-methyl-3-pentenoyl)-5-(3-methyl-2-butenyl)-2-cyclopentene-1-one|2-(2-Methylbutyryl)-3,4-dihydroxy-5-(3-methyl-2-butenyl)-4-(4-methyl-3-pentenoyl)-2-cyclopentene-1-one|2-Cyclopenten-1-one,3,4-dihydroxy-5-(3-methyl-2-buten-1-yl)-2-(2-methyl-1-oxobutyl)-4-(4-methyl-1-oxo-3-penten-1-yl)-|3,4-Dihydroxy-5-(3-methyl-2-butenyl)-2-(2-methyl-1-oxobutyl)-4-(4-methyl-1-oxo-3-pentenyl)-2-cyclopenten-1-one|3,4-DIHYDROXY-5-(3-METHYLBUT-2-EN-1-YL)-2-(2-METHYLBUTANOYL)-4-(4-METHYLPENT-3-ENOYL)CYCLOPENT-2-EN-1-ONE

Molecular Formula	C21H30O5
Molecular Weight	362.20932 g/mol
LogP	3.63
Topological Polar Surface Area	91.67 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	8
Exact Mass	362.20932
Heavy Atoms	26
Complexity	687.2

Chemical Identifiers

CAS Number	25422-83-7
SMILES	CCC(C)C(=O)C1=C(C(C(C1=O)CC=C(C)C)(C(=O)CC=C(C)C)O)O