Compound Identification
SMILES
CC(C)CC(=O)C1=C(O)C(C=O)=C2O[C@]3(CC[C@H]4C[C@@H]3C4(C)C)CCC2=C1O
InChIKey
InChIKey=XREJXBXJCWWRFP-OLJPZDALSA-N
Formula
C23H30O5
Mass
386.488
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Bicyclic monoterpenoids Aromatic monoterpenoids 1-benzopyrans Aryl alkyl ketones Aryl-aldehydes Alkyl aryl ethers Vinylogous acids Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Aromatic monoterpenoid - Chromane - Benzopyran - Pinane monoterpenoid - Nopinane monoterpenoid - Monoterpenoid - 1-benzopyran - Aryl ketone - Aryl alkyl ketone - Aryl-aldehyde - Alkyl aryl ether - Vinylogous acid - Ketone - Ether - Organoheterocyclic compound - Oxacycle - Aldehyde - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available