Compound Identification
SMILES
CCC(C)\C=C(/C)\C=C\C(\O)=C\C(=O)[C@@H]1[C@@H]2C3=COC(CC(C)O)=CC3=CC(=O)[C@]2(C)OC1=O
InChIKey
InChIKey=FRERSNXTZNXIGN-OGDDRNBVSA-N
Formula
C27H32O7
Mass
468.546
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
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Level 6
Cyclic ketones
- Level 7 Cyclohexenones
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Level 6
Cyclic ketones
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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 1,3-dicarbonyl compounds Pyrans Gamma butyrolactones Vinylogous acids Oxolanes Acryloyl compounds Enones Secondary alcohols Carboxylic acid esters Enols Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Aldehydes Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cyclohexenone - Alpha-acyloxy ketone - Gamma butyrolactone - Pyran - 1,3-dicarbonyl compound - Acryloyl-group - Enone - Oxolane - Alpha,beta-unsaturated ketone - Vinylogous acid - Lactone - Carboxylic acid ester - Secondary alcohol - Monocarboxylic acid or derivatives - Enol - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Aldehyde - 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