Compound Identification
SMILES
CCCCC(N)=NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1CC1=C2C=C(O)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=AJIUFNKLTBLQHQ-SWSYLUTGSA-N
Formula
C42H63N5O3
Mass
685.998
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
6,7-benzomorphans
- Subclass 2,6-dimethyl-3-benzazocines
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Class
6,7-benzomorphans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
6,7-benzomorphans
Subclass
2,6-dimethyl-3-benzazocines
Intermediate Tree Nodes
Not available
Direct Parent
2,6-dimethyl-3-benzazocines
Alternative Parents
4-hydroxy-6,7-benzomorphans Leucine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzazocines Tetralins Phenylacetamides Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Piperidines N-acyl amines Cyclopropanecarboxylic acids and derivatives Secondary carboxylic acid amides Trialkylamines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Carboxamidines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,6-dimethyl-3-benzazocine - 4-hydroxy-6,7-benzomorphan - Leucine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzazocine - Tetralin - Phenylacetamide - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Piperidine - Fatty acyl - Fatty amide - N-acyl-amine - Benzenoid - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Amidine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboximidamide - Carboxylic acid amidine - Amine - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2,6-dimethyl-3-benzazocines. These are aromatic compounds containing a 6,7-benzomorphan skeleton, which is substituted by methyl group at the 2- and 6-positions.
External Descriptors
Not available