Compound Identification
SMILES
CC[NH+](CC)CCN1[C@H](C2=CC=C(C)O2)C(C(=O)C2=CC=CS2)=C(O)C1=O
InChIKey
InChIKey=RISFOFCLKFTHBV-QGZVFWFLSA-O
Formula
C20H25N2O4S
Mass
389.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Pyrroline carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroline carboxylic acids and derivatives
Alternative Parents
Aryl ketones Vinylogous acids Furans Heteroaromatic compounds Quaternary ammonium salts Tertiary carboxylic acid amides Thiophenes Lactams Amino acids and derivatives Trialkylamines Oxacyclic compounds Enols Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrroline carboxylic acid or derivatives - Aryl ketone - Furan - Quaternary ammonium salt - Tertiary carboxylic acid amide - Heteroaromatic compound - Thiophene - Vinylogous acid - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Tertiary amine - Tertiary aliphatic amine - Enol - Oxacycle - Carboxylic acid derivative - Azacycle - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroline carboxylic acids and derivatives. These are heterocyclic compounds containing a pyrroline ring substituted by one or more carboxylic acid groups (or derivative thereof).
External Descriptors
Not available