Structure Information
Structure

Compound Identification

SMILES

CCC(SC1=CC=CC(NC(=O)C(\NC(=O)C2=CC=CC=C2)=C/C2=C(OC)C=C(O)C=C2)=C1)C(=O)NC1=C(C#N)C2=C(CN(CC3=CC=CC=C3)CC2)S1

InChIKey

InChIKey=ZUCSLYLHQMKCAP-XICOUIIWSA-N

Formula

C42H39N5O5S2

Mass

757.92

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzamides

Direct Parent

Hippuric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Hydroxycinnamic acid or derivatives - Cinnamic acid amide - Cinnamic acid or derivatives - Alpha-amino acid or derivatives - Methoxyphenol - Thienopyridine - Anilide - Methoxybenzene - Thiophenol ether - Benzylamine - Benzoyl - Anisole - Phenol ether - N-arylamide - Phenylmethylamine - Phenoxy compound - Aryl thioether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Alkylarylthioether - Phenol - Fatty amide - Fatty acyl - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Sulfenyl compound - Thioether - Carboxylic acid derivative - Nitrile - Ether - Carbonitrile - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Carbonyl group - Organic oxide - Amine - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Cyanide - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

Previous Back Next