Structure Information
Structure

Compound Identification

SMILES

C[C@H](O)C1C2SC(CN3C4=CC=CC5=C(CC[N+]67CC[N+](CCCSC8=CC=CC=C8)(CC6)CC7)C=CC(=C45)S3(=O)=O)=C(N2C1=O)C(O)=O

InChIKey

InChIKey=FBNZDLDAMBLCDE-NHMODCAESA-O

Formula

C36H42N4O6S3

Mass

722.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

1-naphthalene sulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Alpha-amino acid or derivatives - 1,2-benzothiazole - Phenethylamine - Aryl thioether - Penem - Thiazolecarboxylic acid or derivatives - Thiophenol ether - N-alkylpiperazine - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Vinylogous thioester - Beta-lactam - Tetraalkylammonium salt - Quaternary ammonium salt - Meta-thiazoline - Thiazole - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Lactam - Carboxamide group - Thioenolether - Secondary alcohol - Azetidine - Thioether - Azacycle - Hemithioaminal - Sulfenyl compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic oxygen compound - Alcohol - Organic oxide - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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