Compound Identification
SMILES
CCC(C)\C=C(/C)\C=C\C1=CC2=C(Cl)C(=O)[C@@]3(C)OC(=O)C(CC(C)O)(OC)[C@H]3C2=CO1
InChIKey
InChIKey=UKIYRTYUFKSWBG-VJZVNDNJSA-N
Formula
C25H31ClO6
Mass
462.97
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
- Level 7 Cyclohexenones
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
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
Ketones - Cyclic ketones
Direct Parent
Cyclohexenones
Alternative Parents
Alpha-acyloxy ketones Pyrans Gamma butyrolactones Oxolanes Alpha-chloroketones Secondary alcohols Carboxylic acid esters Vinyl chlorides Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cyclohexenone - Alpha-acyloxy ketone - Gamma butyrolactone - Pyran - Alpha-haloketone - Alpha-chloroketone - Oxolane - Carboxylic acid ester - Lactone - Secondary alcohol - Vinyl halide - Vinyl chloride - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Chloroalkene - Organoheterocyclic compound - Haloalkene - Hydrocarbon derivative - Organochloride - Organohalogen compound - Organic oxide - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.
External Descriptors
Not available