Compound Identification
SMILES
OC(CC(O)=O)C(O)=O.O=C1C2=CC=CC=C2CCC11CCN(CC2=CC3=CC=CC=C3C=C2)CC1
InChIKey
InChIKey=QUQMOHUMJDEGJV-UHFFFAOYSA-N
Formula
C29H31NO6
Mass
489.568
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
Naphthalenes Aryl alkyl ketones Short-chain hydroxy acids and derivatives Beta hydroxy acids and derivatives Aralkylamines Piperidines Fatty acids and conjugates Dicarboxylic acids and derivatives Alpha hydroxy acids and derivatives Trialkylamines Secondary alcohols Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Naphthalene - Tetralin - Aryl alkyl ketone - Aryl ketone - Beta-hydroxy acid - Aralkylamine - Short-chain hydroxy acid - Alpha-hydroxy acid - Dicarboxylic acid or derivatives - Hydroxy acid - Fatty acid - Piperidine - Ketone - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Alcohol - Carbonyl group - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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