Compound Identification
SMILES
OS(=O)(=O)C(F)(F)F.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=XFGWWYKHXRSVEI-UXMJBONQSA-P
Formula
C32H39F3N4O11S2
Mass
776.8
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 Benzothiazoles Phenethylamines Trifluoromethanesulfonates Pyrroline carboxylic acids Aralkylamines N-alkylpiperazines Azepines Organosulfonamides Dicarboxylic acids and derivatives Sulfonyls Organosulfonic acids Methanesulfonates Tetraalkylammonium salts Tertiary carboxylic acid amides Secondary alcohols Trihalomethanes Azetidines Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organofluorides Organic oxides Alkyl fluorides Carbonyl compounds Organic cations
Molecular Framework
Not available
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 - Trifluoromethanesulfonate - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Aralkylamine - N-alkylpiperazine - Azepine - Dicarboxylic acid or derivatives - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Methanesulfonate - Beta-lactam - Tetraalkylammonium salt - Alkanesulfonic acid - Pyrroline - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid - Secondary alcohol - Carboxamide group - Lactam - Trihalomethane - Azetidine - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Halomethane - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Organosulfur compound - Alcohol - Alkyl fluoride - Alkyl halide - Amine - Organic oxygen compound - Organic nitrogen 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