Compound Identification
SMILES
Br[C@@]12C=C[C@@H](CC1=O)[C@@H]1O[C@@H](O[C@H]21)C1=CC=CC=C1
InChIKey
InChIKey=PSDHNFCDUJWNSW-PSWFKFNGSA-N
Formula
C15H13BrO3
Mass
321.17
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
- Level 7 Cyclohexenones
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Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
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 Alpha-haloketones 1,3-dioxolanes Oxacyclic compounds Acetals Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclohexenone - Benzenoid - Monocyclic benzene moiety - Alpha-haloketone - Meta-dioxolane - Acetal - Oxacycle - Organoheterocyclic compound - Organic oxide - Organohalogen compound - Organobromide - Alkyl halide - Alkyl bromide - Aldehyde - Hydrocarbon derivative - Aromatic 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