Compound Identification
SMILES
CNCCC(=O)O\C=C1\CCC2C(C1C)C(=O)CC1C(C)(C)[C@H](CC[C@]21C)OC(=O)CC(C)(C)O
InChIKey
InChIKey=IKKLVQWYZKTIQO-JRWIOLARSA-N
Formula
C28H45NO6
Mass
491.669
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenanthrenes and derivatives
- Subclass Hydrophenanthrenes
-
Class
Phenanthrenes and derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenanthrenes and derivatives
Subclass
Hydrophenanthrenes
Intermediate Tree Nodes
Not available
Direct Parent
Hydrophenanthrenes
Alternative Parents
Beta amino acids and derivatives Fatty acid esters Dicarboxylic acids and derivatives Tertiary alcohols Enol esters Ketones Dialkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Hydrophenanthrene - Beta amino acid or derivatives - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Tertiary alcohol - Enol ester - Amino acid or derivatives - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Secondary aliphatic amine - Secondary amine - Hydrocarbon derivative - Organic oxide - Alcohol - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydrophenanthrenes. These are a phenanthrene derivative where at least one ring CC bond is substituted by hydrogenation.
External Descriptors
Not available