Compound Identification
SMILES
CC(C)CC(=O)C1=C(O)C(C(=O)CC(C)C)=C2O[C@]3(CCC2=C1O)[C@@H]1CC[C@@H](C1)C3(C)C
InChIKey
InChIKey=QTNQHDPCTDYNED-ANAQZDLVSA-N
Formula
C27H38O5
Mass
442.596
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
Aromatic monoterpenoids 1-benzopyrans Aryl alkyl ketones Phenols Alkyl aryl ethers Vinylogous acids Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Aromatic monoterpenoid - Chromane - Benzopyran - Norbornane monoterpenoid - Monoterpenoid - 1-benzopyran - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Phenol - Vinylogous acid - Ketone - Organoheterocyclic compound - Ether - Oxacycle - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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