Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(CNC[C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)C(CC(O)=O)CS(=O)(=O)CCC(C)C)=C1

InChIKey

InChIKey=XVPFMZNQQXQGTI-HUASTKEASA-N

Formula

C28H40N2O7S

Mass

548.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylbutylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbutylamines

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Phenylbutylamine - Amphetamine or derivatives - Phenoxy compound - Anisole - Benzylamine - Phenylmethylamine - Methoxybenzene - Phenol ether - Alkyl aryl ether - Hydroxy fatty acid - Thia fatty acid - Aralkylamine - Fatty amide - Fatty acyl - N-acyl-amine - Sulfone - Sulfonyl - 1,2-aminoalcohol - Amino acid or derivatives - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Secondary amine - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Ether - Amine - Carbonyl group - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - Alcohol - 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

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