Compound Identification
SMILES
[H]C1(C)[C@@]([H])(OCOC)C(=O)CC2([H])C3=C(C)C=C(OC)C=C3CCC12C(=O)OC
InChIKey
InChIKey=BNLGAYOXXFBKMI-XOZQXLQBSA-N
Formula
C21H28O6
Mass
376.449
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
Naphthalenecarboxylic acids Tetralins Anisoles Alkyl aryl ethers Methyl esters Cyclic ketones Monocarboxylic acids and derivatives Acetals Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Hydrophenanthrene - 2-naphthalenecarboxylic acid or derivatives - 2-naphthalenecarboxylic acid - Tetralin - Anisole - Alkyl aryl ether - Methyl ester - Carboxylic acid ester - Cyclic ketone - Ketone - Acetal - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic 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