Compound Identification
SMILES
CCC12CCN(CC3CCC3)C(CC3=C1C=C(O)C=C3)C2(C)C
InChIKey
InChIKey=IUUBFDSJJHOTDI-UHFFFAOYSA-N
Formula
C21H31NO
Mass
313.485
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
6,7-benzomorphans
- Subclass 4-hydroxy-6,7-benzomorphans
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Class
6,7-benzomorphans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
6,7-benzomorphans
Subclass
4-hydroxy-6,7-benzomorphans
Intermediate Tree Nodes
Not available
Direct Parent
4-hydroxy-6,7-benzomorphans
Alternative Parents
Benzazocines Tetralins Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Piperidines Trialkylamines Azacyclic compounds Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-hydroxy-6,7-benzomorphan - Benzazocine - Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Piperidine - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 4-hydroxy-6,7-benzomorphans. These are aromatic heteropolycyclic compounds containing a 6,7-benzomorphan skeleton, which is hydroxylated at the ring 4-position.
External Descriptors
Not available