Structure Information
Structure

Compound Identification

SMILES

C[C@H]1C=CC2C11COC(=O)[C@@]21C1=CC=CC=C1

InChIKey

InChIKey=TYWPGKGHFFDQIH-JPUFDJIESA-N

Formula

C15H14O2

Mass

226.275

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactones

Subclass

Delta valerolactones

Intermediate Tree Nodes

Not available

Direct Parent

Delta valerolactones

Alternative Parents

Oxanes Gamma butyrolactones Benzene and substituted derivatives Oxolanes Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Delta valerolactone - Delta_valerolactone - Monocyclic benzene moiety - Gamma butyrolactone - Benzenoid - Oxane - Oxolane - Carboxylic acid ester - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.

External Descriptors

Not available

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