Structure Information
Structure

Compound Identification

SMILES

COC(=O)C[C@H]1CCC[C@H](OO1)C1=CC=C(C)O1

InChIKey

InChIKey=PMMDPLAYZIAHKN-PWSUYJOCSA-N

Formula

C13H18O5

Mass

254.282

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Dioxepanes

Subclass

1,2-dioxepanes

Intermediate Tree Nodes

Not available

Direct Parent

1,2-dioxepanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1,2-dioxepane - Heteroaromatic compound - Methyl ester - Furan - Dialkyl peroxide - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 1,2-dioxepanes. These are dioxepanes with the two ring oxygen atoms at position 1 and 2, respectively.

External Descriptors

Not available

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