Compound Identification
SMILES
COC1=C2O[C@H]3C4=C(CC5[C@H]6CC(C=C1)=C2[C@@]35CCN6C)C(C)=C(N4)C(=O)N1CCN(CC1)C1=C(Cl)C=C(C=N1)C(F)(F)F
InChIKey
InChIKey=HIXBNTQCVUPZRS-CORNBYKQSA-N
Formula
C32H33ClF3N5O3
Mass
628.09
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Morphinans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Morphinans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Morphinans
Alternative Parents
Phenanthrenes and derivatives Pyridinylpiperazines N-arylpiperazines Tetralins Coumarans Indoles and derivatives 2-heteroaryl carboxamides Pyrrole carboxamides Anisoles Dialkylarylamines Alkyl aryl ethers Aminopyridines and derivatives Aralkylamines Substituted pyrroles Piperidines Aryl chlorides Imidolactams Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Organochlorides Organofluorides Alkyl fluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Morphinan - Phenanthrene - Pyridinylpiperazine - N-arylpiperazine - Tetralin - Coumaran - Indole or derivatives - 2-heteroaryl carboxamide - Anisole - Phenol ether - Dialkylarylamine - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Alkyl aryl ether - Aminopyridine - Aralkylamine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Piperidine - Pyridine - Imidolactam - Benzenoid - Substituted pyrrole - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Amine - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Alkyl fluoride - Organic oxygen compound - Organochloride - Organic oxide - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as morphinans. These are polycyclic compounds with a four-ring skeleton with three condensed six-member rings forming a partially hydrogenated phenanthrene moiety, one of which is aromatic while the two others are alicyclic.
External Descriptors
Not available