Compound Identification
SMILES
C[C@@H](O)C1C2[C@@H](C)C(CN3C4=CC=CC5=C(CC[N+]67CC[N+](CC(O)=O)(CC6)CC7)C=CC(=C45)S3(=O)=O)=C(N2C1=O)C(O)=O
InChIKey
InChIKey=HZVHQESSVZWQQC-NETOQNFASA-P
Formula
C31H38N4O8S
Mass
626.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
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
1-naphthalene sulfonamides Carbapenems Alpha amino acids Phenethylamines Benzothiazoles Pyrroline carboxylic acids Aralkylamines Azepines N-alkylpiperazines Organosulfonamides Dicarboxylic acids and derivatives Tetraalkylammonium salts Tertiary carboxylic acid amides Azetidines Secondary alcohols Carboxylic acids Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Carbapenem - Alpha-amino acid - Alpha-amino acid or derivatives - 1,2-benzothiazole - Phenethylamine - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Aralkylamine - Azepine - N-alkylpiperazine - 1,4-diazinane - Organosulfonic acid amide - Dicarboxylic acid or derivatives - Piperazine - Beta-lactam - Tetraalkylammonium salt - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrroline - Quaternary ammonium salt - Secondary alcohol - Azetidine - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Amine - Organooxygen compound - Organic nitrogen compound - 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