Structure Information
Structure

Compound Identification

SMILES

[H][C@]12C[C@@]3([H])[C@@]([H])([C@@]1([H])CC(=O)O2)C1(C)C2([H])C[C@@]3(O)O[C@@]1(C#COCC)C(C)=CC2=O

InChIKey

InChIKey=DTLGRNGLKWEKOW-QDNNSELKSA-N

Formula

C21H24O6

Mass

372.417

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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

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cyclohexenone - Gamma butyrolactone - Oxane - Ynone - Tetrahydrofuran - Cyclic alcohol - Carboxylic acid ester - Lactone - Hemiacetal - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Hydrocarbon derivative - Organic oxide - Aliphatic heteropolycyclic 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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