Structure Information
Structure

Compound Identification

SMILES

C[C@H](CCCC1=CC=CC=C1)OC1=CC2=C3CCCCC3C3CCC(=O)CC3C2C(=O)C1

InChIKey

InChIKey=XMIFHESRBRLFCA-TWSQBAJSSA-N

Formula

C29H36O3

Mass

432.604

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Benzene and substituted derivatives Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Cyclohexenone - Benzenoid - Monocyclic benzene moiety - Organic oxide - Hydrocarbon derivative - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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