Structure Information
Structure

Compound Identification

SMILES

COC1=C(C)C=C2C[C@H]3[C@H](C#N)N4[C@H]5COC(=O)[C@H](CS[C@@H]([C@H]4[C@H](N3C(=O)OCC=C)C2=C1OCC=C)C1=C5C2=C(OCO2)C(C)=C1O)NC(=O)OCC(Cl)(Cl)Cl

InChIKey

InChIKey=YIWRCXSITNIDNM-BPUKYHHHSA-N

Formula

C38H39Cl3N4O11S

Mass

866.16

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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

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Benzazocine - Tetrahydroisoquinoline - Benzodioxole - Piperazine-1-carboxylic acid - Anisole - Alkyl aryl ether - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Benzenoid - Carbamic acid ester - Carboxylic acid ester - Alpha-aminonitrile - Lactone - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Dialkylthioether - Organoheterocyclic compound - Azacycle - Thioether - Acetal - Ether - Monocarboxylic acid or derivatives - Nitrile - Carbonitrile - Alkyl halide - Organohalogen compound - Alkyl chloride - Organochloride - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Cyanide - Organopnictogen compound - Amine - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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