Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CCNC(=O)C(O)C(N)CCCN=C(N)NS(=O)OC2=C(C)C(C)=C(OC)C=C2C)C=C1

InChIKey

InChIKey=PEPVBWKUEJGJGL-UHFFFAOYSA-N

Formula

C26H39N5O6S

Mass

549.69

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Beta amino acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - Monosaccharide - N-acyl-amine - Carboxamide group - Guanidine - Secondary carboxylic acid amide - Secondary alcohol - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Primary aliphatic amine - Amine - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Primary amine - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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