Compound Identification
SMILES
COC1=CC=CC(CNC[C@@H](O)[C@H](CC2=CC=CC=C2)NC(=O)O[C@@H]2C[C@H](C)CC[C@H]2C(C)C)=C1
InChIKey
InChIKey=RIDLCQCWEKPREE-WFDYCHIHSA-N
Formula
C29H42N2O4
Mass
482.665
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Amphetamines and derivatives Monocyclic monoterpenoids Menthane monoterpenoids Aromatic monoterpenoids Phenylmethylamines Phenoxy compounds Anisoles Methoxybenzenes Benzylamines Alkyl aryl ethers Aralkylamines Carbamate esters 1,2-aminoalcohols Secondary alcohols Dialkylamines Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - P-menthane monoterpenoid - Phenoxy compound - Methoxybenzene - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Aralkylamine - Alkyl aryl ether - Carbamic acid ester - 1,2-aminoalcohol - Secondary alcohol - Ether - Secondary aliphatic amine - Secondary amine - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Carbonyl group - Alcohol - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available