Structure Information
Structure

Compound Identification

SMILES

CN(CCOC1=CC=C(C[C@H](NC2=CC=CC=C2C(=O)C2=CC=CC=C2)C(O)=O)C=C1)C1=CC=CC(NCCCCCCCCSC2=CC=C(C=C2)C(\C)=C\C=C\C(\C)=C/C(O)=O)=N1

InChIKey

InChIKey=ACWCPYHBLRQBKA-AGABSLRMSA-N

Formula

C53H60N4O6S

Mass

881.15

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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

Phenylalanine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylalanine or derivatives - Benzophenone - Diphenylmethane - Aryl-phenylketone - 3-phenylpropanoic-acid - Monocyclic monoterpenoid - Aromatic monoterpenoid - L-alpha-amino acid - Amphetamine or derivatives - Alpha-amino acid - Monoterpenoid - Phenylpropene - Aryl ketone - Phenylalkylamine - Aniline or substituted anilines - Phenoxy compound - Dialkylarylamine - Phenol ether - Medium-chain fatty acid - Thiophenol ether - Aryl thioether - Benzoyl - Styrene - Alkyl aryl ether - Aminopyridine - Heterocyclic fatty acid - Secondary aliphatic/aromatic amine - Branched fatty acid - Aralkylamine - Alkylarylthioether - Methyl-branched fatty acid - Pyridine - Fatty acid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Unsaturated fatty acid - Imidolactam - Fatty acyl - Benzenoid - Vinylogous amide - Heteroaromatic compound - Amino acid - Ketone - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Secondary amine - Carboxylic acid - Ether - Organic oxide - Amine - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organosulfur compound - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine 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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