Compound Identification
SMILES
CCC(=O)C(\C)=C\C=C\[C@H]1[C@@H]2CC[C@](C)(O)C[C@H]2[C@@H]2O[C@]2(C)[C@H]1\C(C)=C\C
InChIKey
InChIKey=VKXPJJBZNMZKHN-IMSAYNGESA-N
Formula
C24H36O3
Mass
372.549
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Oxepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxepanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxepanes
Alternative Parents
Alpha-branched alpha,beta-unsaturated ketones Tertiary alcohols Enones Acryloyl compounds Ketones Cyclic alcohols and derivatives Oxacyclic compounds Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Oxepane - Alpha-branched alpha,beta-unsaturated-ketone - Alpha,beta-unsaturated ketone - Tertiary alcohol - Enone - Cyclic alcohol - Acryloyl-group - Ketone - Oxacycle - Ether - Oxirane - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as oxepanes. These are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms.
External Descriptors
Not available