Structure Information
Structure

Compound Identification

SMILES

CC(C)N(CC(C)=O)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC1=CNC2=CC=CC=C12)C(C)=O)S(=O)C1=CC(=CC(=C1)C(=O)NC(CC(O)=O)C(C)=O)C(=O)NC(CC1=CC=CC=C1)C(C)=O

InChIKey

InChIKey=JIXUFBAPHQMPQM-UHFFFAOYSA-N

Formula

C49H51N5O11S

Mass

918.03

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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 - Amphetamine or derivatives - M-sulfanylbenzoic acid or derivatives - 3-alkylindole - Phenyl sulfoxide - Benzamide - Benzoic acid or derivatives - Indole or derivatives - Indole - Benzoyl - Gamma-keto acid - Monocyclic benzene moiety - Benzenoid - Keto acid - Substituted pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Ketone - Sulfoxide - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - 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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