Structure Information
Structure

Compound Identification

SMILES

C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(CN3CC4=CC=CC5=C(C[N+]67CC[N+](CC(=O)NCCN)(CC6)CC7)C=CC(=C45)S3(=O)=O)=C(N2C1=O)C(O)=O

InChIKey

InChIKey=IYISIIUPGJAWHN-WSSIPFNWSA-P

Formula

C33H44N6O7S

Mass

668.81

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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 - N-piperazineacetamide - Benzothiazine - Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Aralkylamine - Azepine - N-alkylpiperazine - Piperazine - 1,4-diazinane - Ortho-thiazine - Organosulfonic acid amide - Tetraalkylammonium salt - Beta-lactam - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Pyrroline - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Azetidine - Amino acid or derivatives - Carboxamide group - Lactam - Amino acid - Secondary alcohol - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Alcohol - Carbonyl group - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen 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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