Compound Identification
SMILES
OC(=O)CN(CC[N+](CCNCCC1=CC=C(C=C1)N=C=S)(CC(O)=O)CC(O)=O)CC(O)=O
InChIKey
InChIKey=JNNLGNAUJSHGQO-UHFFFAOYSA-O
Formula
C21H29N4O8S
Mass
497.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Tetracarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Tetracarboxylic acids and derivatives
Alternative Parents
Alpha amino acids Phenethylamines Aralkylamines Tetraalkylammonium salts Trialkylamines Isothiocyanates Amino acids Dialkylamines Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Tetracarboxylic acid or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - Phenethylamine - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Tetraalkylammonium salt - Quaternary ammonium salt - Tertiary aliphatic amine - Amino acid - Tertiary amine - Amino acid or derivatives - Isothiocyanate - Secondary amine - Carboxylic acid - Secondary aliphatic amine - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as tetracarboxylic acids and derivatives. These are carboxylic acids containing exactly four carboxyl groups.
External Descriptors
Not available