Compound Identification
SMILES
CSC1=CC=C2C3=C(O)C(O)=C(O)C=C3CC[C@H](NC(=O)C34CC5CC(CC(C5)C3)C4)C2=CC1=O
InChIKey
InChIKey=PEKIAJGFWDEKHT-XVWUWYCTSA-N
Formula
C28H31NO5S
Mass
493.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Hydrocarbon derivatives
- Class Tropones
-
Superclass
Hydrocarbon derivatives
Kingdom
Organic compounds
Superclass
Hydrocarbon derivatives
Class
Tropones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tropones
Alternative Parents
Alkylarylthioethers 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Secondary carboxylic acid amides Cyclic ketones Sulfenyl compounds Polyols Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Aryl thioether - Tropone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkylarylthioether - Benzenoid - Carboxamide group - Cyclic ketone - Secondary carboxylic acid amide - Carboxylic acid derivative - Sulfenyl compound - Thioether - Polyol - Carbonyl group - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as tropones. These are compounds containing a tropone ring, which is a cycloheptatrienone ring bearing a ketone group.
External Descriptors
Not available