Structure Information
Structure

Compound Identification

SMILES

CCN(CCOC(=O)CCC(=O)N1C[C@@H](NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)C2=CC3=CC(=C2)C(=O)N[C@@H]2CCCCC2NC(=O)C2=CC=CC(=C2)C(=O)N[C@@H]2CCCCC2NC3=O)[C@@H](C1)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C1=CC2=CC(=C1)C(=O)NC1CCCC[C@H]1NC(=O)C1=CC=CC(=C1)C(=O)NC1CCCC[C@H]1NC2=O)C1=CC=C(C=C1)N=NC1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=VLZJJJOTSOAYSN-XSWSKQBVSA-N

Formula

C100H109N17O17

Mass

1821.074

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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 - Azobenzene - Macrolactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - N-acylpyrrolidine - Fatty acid ester - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Fatty amide - Pyrrolidine - Tertiary carboxylic acid amide - Azo compound - Carboxamide group - Carboxylic acid ester - Lactam - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Tertiary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic zwitterion - Organic nitrogen compound - Amine - Organooxygen compound - Organic salt - Organic oxide - Organonitrogen compound - 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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