Compound Identification
SMILES
COC(=O)C(=O)C1CCCOC1C1(C2OCCC2C1=O)C1=CC=CC=C1
InChIKey
InChIKey=WZTQCDBQKYDPLT-UHFFFAOYSA-N
Formula
C20H22O6
Mass
358.39
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
Oxanes Benzene and substituted derivatives Alpha-keto acids and derivatives Tetrahydrofurans Methyl esters Ketones Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Oxepane - Alpha-keto acid - Monocyclic benzene moiety - Keto acid - Oxane - Benzenoid - Methyl ester - Tetrahydrofuran - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Aromatic 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