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=AZACHTBBKWDCTE-NHMODCAESA-N
Formula
C36H40N4O6S3
Mass
720.92
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 Alpha amino acids and derivatives Benzothiazoles Phenethylamines Thiophenol ethers Thiazolecarboxylic acids and derivatives Penems Alkylarylthioethers Aralkylamines N-alkylpiperazines Vinylogous thioesters Organosulfonamides Thiazolines Tetraalkylammonium salts Tertiary carboxylic acid amides Carboxylic acid salts Thioenol ethers Azetidines Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Hydrocarbon derivatives Carbonyl compounds Alkoxides Organic oxides Organic salts Organic zwitterions
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 - Thiazolecarboxylic acid or derivatives - Thiophenol ether - Penem - N-alkylpiperazine - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Organosulfonic acid amide - 1,4-diazinane - Vinylogous thioester - Piperazine - Organic sulfonic acid or derivatives - Tetraalkylammonium salt - Organosulfonic acid or derivatives - Quaternary ammonium salt - Beta-lactam - Meta-thiazoline - Tertiary carboxylic acid amide - Thiazole - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Thioenolether - Thioether - Hemithioaminal - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alkoxide - Organosulfur compound - Organic salt - Organic zwitterion - 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