Compound Identification
SMILES
NC1=CC2=C(C[C@@]3(O)CC4N(CC5CC5)CC[C@]33C2OC2=C(O)C=CC4=C32)S1
InChIKey
InChIKey=MHXYHSCPOZPLKA-CDXHVJTCSA-N
Formula
C22H24N2O3S
Mass
396.51
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
Naphthothiophenes Benzazepines Tetralins Coumarans 2,3,5-trisubstituted thiophenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines Azepanes Azepines 2-aminothiophenes Tertiary alcohols Heteroaromatic compounds Trialkylamines Azacyclic compounds Oxacyclic compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenanthrene - Naphthothiophene - Benzazepine - Tetralin - Coumaran - 2,3,5-trisubstituted thiophene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Azepane - Azepine - Aralkylamine - Phenol - 2-aminothiophene - Heteroaromatic compound - Thiophene - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Primary amine - Organic nitrogen compound - Aromatic heteropolycyclic 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