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Compound Summary

General Compound Information

Cohumulone

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Description

Cohumulone is a secondary alpha-hydroxy ketone.

Synonyms

Cohumulone; 511-25-1; 142628-20-4; 2Y34G4NIC8; 5-(alpha,beta-Dibromophenethyl)-5-methylhydantoin;

UNII-2Y34G4NIC8;3,5,6-trihydroxy-4,6-bis(3-methylbut-2-enyl)-2-(2-methylpropanoyl)cyclohexa-2,4-dien-1-one;2,5-Cyclohexadien-1-one, 3,4,5-trihydroxy-2-isobutyryl-4,6-bis(3-methyl-2-butenyl)-;(+/-)-cohumulone;COHUMULONE, (-)-;SCHEMBL317724;SCHEMBL13629034;DTXSID20931549;CHEBI:175443;DTXSID701318500;Q2981886;Q27893896;(-)-3,4,5-TRIHYDROXY-2,4-BIS(3-METHYL-2-BUTEN-1-YL)-6-(2-METHYL-1-OXOPROPYL)-2,5-CYCLOHEXADIEN-1-ONE;2,5-CYCLOHEXADIEN-1-ONE, 3,4,5-TRIHYDROXY-2,4-BIS(3-METHYL-2-BUTEN-1-YL)-6-(2-METHYL-1-OXOPROPYL)-, (-)-;3,4,5-Trihydroxy-2,4-bis(3-methyl-2-butenyl)-6-(2-methyl-1-oxopropyl)-2,5-cyclohexadien-1-one, 9CI;3,5,6-TRIHYDROXY-4,6-BIS(3-METHYLBUT-2-EN-1-YL)-2-(2-METHYLPROPANOYL)CYCLOHEXA-2,4-DIEN-1-ONE;

FlavorDB ID

4186

PUBCHEM ID

196915

Molecular Weight

348.4 Molecular Formula

C20H28O5

Openeye Can Smiles

CC(C)C(=O)C1=C(C(=C(C(C1=O)(CC=C(C)C)O)O)CC=C(C)C)O

IUPAC Inchikey

DRSITEVYZGOOQG-UHFFFAOYSA-N

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Compound Classification

Classification (Parent Nodes)

ClassyFire Ontology

Compound Quality

Quality information of this compound is not available!

Compound Toxicity

Toxicity and Food Additive Safety of this compound is not available!

Receptors

Receptor	REFERENCE	EC50 [µM]	Effective Concentration [µM]
TAS2R1	details	0.20	0.00
TAS2R40	details	0.00	0.00

Consensus Spectra

Spectrum Type	Spectrum View	Description	Polarity
Experimental LCMS	view	LCMS_Positive	positive
Experimental LCMS	view	LCMS_Negative	negative