Structure Information
Structure

Compound Identification

SMILES

CN(C(CC1=CC=CC=C1)C(=O)NCCO)C(=O)C12CC3OC(=O)C1N(CC1=CC=CC=C1C=CC(=O)OC1C(=O)OCC1(C)C)OC2C1OC(OC31)(C1CC1)C1CC1

InChIKey

InChIKey=QIXDORMRKFJEHP-UHFFFAOYSA-N

Formula

C44H51N3O12

Mass

813.901

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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 heteropolycyclic compounds

Substituents

Phenylalanine or derivatives - Alpha-amino acid ester - Cinnamic acid or derivatives - Cinnamic acid ester - Amphetamine or derivatives - Tricarboxylic acid or derivatives - N-acylethanolamine - Styrene - Ketal - Delta valerolactone - Fatty acid ester - Delta_valerolactone - Monocyclic benzene moiety - Fatty amide - Gamma butyrolactone - Oxane - Fatty acyl - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Oxolane - Enoate ester - Isoxazolidine - Tertiary carboxylic acid amide - Meta-dioxolane - Secondary carboxylic acid amide - Lactone - Carboxamide group - Carboxylic acid ester - N-organohydroxylamine - Alkanolamine - Organoheterocyclic compound - Azacycle - Oxacycle - Acetal - Organic oxygen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic 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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