Compound Identification
SMILES
CO[C@@H]1O[C@@]2(O)C\C(C)=C/C(=O)CC(=C)CC[C@@H]3CC[C@]11O[C@]21C3(C)C
InChIKey
InChIKey=WHHRTYNDXASKPJ-ZUJOZZIKSA-N
Formula
C21H30O5
Mass
362.466
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
Monosaccharides 1,4-dioxanes Tetrahydrofurans Hemiacetals Cyclic ketones Oxacyclic compounds Epoxides Dialkyl ethers Acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Oxepane - Monosaccharide - Para-dioxane - Tetrahydrofuran - Cyclic ketone - Ketone - Hemiacetal - Oxacycle - Ether - Oxirane - Dialkyl ether - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - 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