Structure Information
Structure

Compound Identification

SMILES

CCCCOC(=O)C(O)C(NC(=O)C1=CC=C2CN(CC(=O)N12)S(=O)(=O)CC1=CC=CC=C1)C1CCC(N)CC1

InChIKey

InChIKey=RFAVPVOPIIHJKP-UHFFFAOYSA-N

Formula

C28H38N4O7S

Mass

574.69

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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 heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - Alpha-amino acid or derivatives - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Cyclohexylamine - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid amide - Substituted pyrrole - Monosaccharide - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Carboxamide group - Carboxylic acid ester - Lactam - Secondary carboxylic acid amide - Secondary alcohol - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organooxygen compound - Primary aliphatic amine - Amine - Organic nitrogen compound - Alcohol - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organosulfur compound - Primary amine - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic 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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