Compound Identification
SMILES
CC[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1CC=C(Cl)[C@]2(C)O
InChIKey
InChIKey=IBMKMQSWGSFOLD-SACAXFFCSA-N
Formula
C21H27ClO2
Mass
346.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenanthrenes and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenanthrenes and derivatives
Alternative Parents
Tetralins 1-hydroxy-2-unsubstituted benzenoids Tertiary alcohols Chlorohydrins Vinyl chlorides Chloroalkenes Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Phenanthrene - Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Tertiary alcohol - Chlorohydrin - Halohydrin - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Organooxygen compound - Organochloride - Organohalogen compound - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.
External Descriptors
Not available