Structure Information
Structure

Compound Identification

SMILES

OCC1=CC=C(C=C1)C1CC(CSC2=CC=CC=C2C(O)=O)OC(O1)C1=CC=C(CNC(=O)CCCC(=O)NO)C=C1

InChIKey

InChIKey=OFZRYRJUSCTHTR-UHFFFAOYSA-N

Formula

C31H34N2O8S

Mass

594.68

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

Sulfanylbenzoic acids and derivatives - O-sulfanylbenzoic acids and derivatives

Direct Parent

O-sulfanylbenzoic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-sulfanylbenzoic acid - Benzoic acid - Aryl thioether - Benzoyl - Benzyl alcohol - Thiophenol ether - Alkylarylthioether - Meta-dioxane - Fatty amide - Vinylogous thioester - Fatty acyl - N-acyl-amine - Carboxamide group - Hydroxamic acid - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Thioether - Organic oxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Aromatic alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary alcohol - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-sulfanylbenzoic acids. These are benzoic acids which bear a sulfanyl group (R-SH) attached to the benzene ring at positions 1 and 2, respectively.

External Descriptors

Not available

Previous Back Next