Structure Information
Structure

Compound Identification

SMILES

ICC1CC2(CC=CCC22OCCO2)CC(=O)O1

InChIKey

InChIKey=AFIRANYOSGVOKM-UHFFFAOYSA-N

Formula

C13H17IO4

Mass

364.179

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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

Ketals Oxanes 1,3-dioxolanes Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organoiodides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl iodides

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Ketal - Delta_valerolactone - Delta valerolactone - Oxane - Meta-dioxolane - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organoiodide - Organohalogen compound - Carbonyl group - Alkyl iodide - Alkyl halide - Aliphatic 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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