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Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@@H](NS(=O)(=O)C1=CC=C(C=C1)C1=CC=C(OC(=O)C2=C(C)C3=CC=CC=C3O2)C=C1)C(O)=O

InChIKey

InChIKey=CDQWPWXRHWRQEJ-XMMPIXPASA-N

Formula

C27H25NO7S

Mass

507.56

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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 heteropolycyclic compounds

Substituents

Valine or derivatives - Biphenyl - Benzenesulfonamide - Phenol ester - Furoic acid ester - Benzofuran - Benzenesulfonyl group - Furoic acid or derivatives - Phenoxy compound - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Organosulfonic acid amide - Benzenoid - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Furan - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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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