Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC=C1CNC(=O)[C@H]1N(CSC1(C)C)C(=O)[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)CC(C)(C)C(=O)OC[C@@H]1O[C@@H](C[C@H]1N=[N+]=[N-])N1C=C(C)C(=O)NC1=O

InChIKey

InChIKey=RQXCOMZVJDKMLZ-ZPVQLGJRSA-N

Formula

C40H50N8O9S

Mass

818.95

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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

Valine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Valine or derivatives - Amphetamine or derivatives - Pyrimidone - Fatty acid ester - Fatty acyl - Benzenoid - Pyrimidine - N-acyl-amine - Monosaccharide - 1,2,3,4-tetrahydropyrimidine - Hydropyrimidine - Fatty amide - Monocyclic benzene moiety - Heteroaromatic compound - N,s-acetal - Vinylogous amide - Thiazolidine - Tetrahydrofuran - Tertiary carboxylic acid amide - Dicarboximide - Organoazide - Alkyl azide - Secondary alcohol - Carbonic acid derivative - Organic azide - Lactam - Carboxylic acid ester - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Hemithioaminal - Thioether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound

Description

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