Structure Information
Structure

Compound Identification

SMILES

COC(=O)c1ccc(cc1)[C@H](CC(=O)N[C@@H](C(C)C)C(\O)=C1\C(=O)NC(O)=C1C)NC(=O)OC(C)(C)C

InChIKey

InChIKey=GAKRRIOPOFSHIZ-NCJRZWPZSA-N

Formula

C26H35N3O8

Mass

517.579

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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 heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Fatty amide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Pyrroline - Carbamic acid ester - Methyl ester - Vinylogous acid - Carboxamide group - Lactam - Ketene acetal or derivatives - Secondary carboxylic acid amide - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Enol - Alkanolamine - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic 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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