Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(NC(=O)COC2=C(C=C(Cl)C=C2)[C@@H]2C3C4CC(C3SC3=C2SC(=O)N3)C2C4C(=O)N(C(C)C(O)=O)C2=O)C=C1

InChIKey

InChIKey=RLGBKXHGUFQUKU-UGQDCKMPSA-N

Formula

C31H28ClN3O8S2

Mass

670.15

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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 - Alpha amino acids and derivatives

Direct Parent

Alanine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alanine or derivatives - Monoterpenoid - Isoindolone - Norbornane monoterpenoid - Aromatic monoterpenoid - Isoindoline - Isoindole or derivatives - Methoxyaniline - Anilide - N-arylamide - Methoxybenzene - Phenol ether - Anisole - Aryl thioether - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Benzenoid - Carboxylic acid imide, n-substituted - N-alkylpyrrolidine - Thiopyran - Pyrrolidone - 2-pyrrolidone - Monocyclic benzene moiety - Carboxylic acid imide - Heteroaromatic compound - Pyrrolidine - Dicarboximide - Thiazole - Azole - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Thioether - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organic oxide - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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