ClassyFire

Compound Identification

SMILES

C\C=C\C(=O)C1=C(C)C=CCC1(C)C

InChIKey

InChIKey=POIARNZEYGURDG-FNORWQNLSA-N

Formula

C13H18O

Mass

190.286

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level 5 Alpha,beta-unsaturated carbonyl compounds
        
        Level 6 Alpha,beta-unsaturated ketones
        
        Level 7 Enones

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Alpha,beta-unsaturated carbonyl compounds - Alpha,beta-unsaturated ketones

Direct Parent

Enones

Alternative Parents

Acryloyl compounds Ketones Organic oxides Hydrocarbon derivatives

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Enone - Acryloyl-group - Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as enones. These are compounds containing the enone functional group, with the structure RC(=O)CR'.

External Descriptors

CHEBI:67251 : enone - apo carotenoid monoterpenoid - cyclic monoterpene ketone
LIPIDMAPS (LMPR01070304) : C40 isoprenoids (tetraterpenes)

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