Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NN(CC1=CC=CC=C1)C[C@@](O)(CC1=CC=CC=C1)C(=O)N[C@@H]1[C@H](O)CC2=CC=CC=C12

InChIKey

InChIKey=ZDEXTHUJCUWMEJ-HKFRAXQBSA-N

Formula

C33H42N4O6S

Mass

622.78

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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 homopolycyclic compounds

Substituents

Valine or derivatives - Beta amino acid or derivatives - Indane - Monocyclic benzene moiety - Fatty amide - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Fatty acyl - Sulfonyl - Aminosulfonyl compound - Organosulfonic acid or derivatives - Tertiary alcohol - Organic sulfonic acid or derivatives - Carboxamide group - Carboxylic acid hydrazide - Secondary alcohol - Secondary carboxylic acid amide - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Carbonyl group - Aromatic homopolycyclic 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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