Structure Information
Structure

Compound Identification

SMILES

CC1=NC2=CC=CC=C2C(COC2=CC=C(C=C2)C(=O)NC2(CC(=O)NO)CCS(=O)CC2)=C1

InChIKey

InChIKey=MKGMFZDKQXICAL-UHFFFAOYSA-N

Formula

C25H27N3O5S

Mass

481.57

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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 - Quinoline - Benzamide - Benzoic acid or derivatives - Phenol ether - Phenoxy compound - Benzoyl - Alkyl aryl ether - Methylpyridine - Benzenoid - Thiane - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Carboxamide group - Sulfoxide - Secondary carboxylic acid amide - Hydroxamic acid - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Ether - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - 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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