Compound Identification
SMILES
C[C@@H]1CC(=O)C2=C(C1)C=C[C@@]1(O)[C@@H](O)C3=C(C=CC=C3O)C(=O)[C@@H]21
InChIKey
InChIKey=KINBEBQZPVMMJN-CRYRNKTMSA-N
Formula
C19H18O5
Mass
326.348
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
Aryl alkyl ketones Cyclohexenones 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Tertiary alcohols Secondary alcohols 1,2-diols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Tetralin - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Cyclohexenone - Tertiary alcohol - 1,2-diol - Ketone - Secondary alcohol - Polyol - Organic oxygen compound - Organooxygen compound - Alcohol - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available