Compound Identification
SMILES
CC(C)CC(=O)C1=C(O)C(CC=C(C)C)=C(O)[C@@](O)(CC=C(C)C)C1=O
InChIKey
InChIKey=VMSLCPKYRPDHLN-NRFANRHFSA-N
Formula
C21H30O5
Mass
362.466
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
- Level 5 Acyloins
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Not available
Direct Parent
Acyloins
Alternative Parents
Vinylogous acids Tertiary alcohols Cyclic ketones Polyols Enols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Acyloin - Vinylogous acid - Tertiary alcohol - Cyclic ketone - Ketone - Polyol - Enol - Organic oxide - Hydrocarbon derivative - Alcohol - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as acyloins. These are organic compounds containing an alpha hydroxy ketone. Acyloins are formally derived from reductive coupling of carboxylic acyl groups.
External Descriptors
Not available