Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(CN3C4=CC=CC5=C(CC[N+]67CC[N+](CC(N)=O)(CC6)CC7)C=CC(=C45)S3(=O)=O)=C(N2C1=O)C(=O)OCC1=CC=CC=C1

InChIKey

InChIKey=RBHXRRWAWIBQCO-MCHDWKKASA-O

Formula

C38H45N5O7S

Mass

715.86

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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 amide - Carbapenem - Alpha-amino acid or derivatives - N-piperazineacetamide - Benzyloxycarbonyl - Phenethylamine - 1,2-benzothiazole - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Azepine - Aralkylamine - N-alkylpiperazine - Organosulfonic acid amide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Quaternary ammonium salt - Pyrroline - Tetraalkylammonium salt - Enoate ester - Beta-lactam - Azetidine - Secondary alcohol - Carboxamide group - Carboxylic acid ester - Primary carboxylic acid amide - Lactam - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Amine - Organic oxide - Organooxygen compound - Organonitrogen compound - 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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