Structure Information
Structure

Compound Identification

SMILES

COCCN1C(C)=CC(C(=O)CSC2=NC(=CC3=CC=C(OC)C=C3)C(=O)N2C2=CC(OC)=CC=C2)=C1C

InChIKey

InChIKey=ZKERQHZBNKEDQR-UHFFFAOYSA-N

Formula

C29H31N3O5S

Mass

533.64

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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

Alpha amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Imidazolinone - Substituted pyrrole - Benzenoid - 2-imidazoline - Heteroaromatic compound - Pyrrole - Vinylogous amide - Ketone - Isothiourea - Organoheterocyclic compound - Organic 1,3-dipolar compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Dialkyl ether - Ether - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.

External Descriptors

Not available

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