Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(C)=C(C1C(=O)OCC(=O)NCCN1C(=O)CSC1=O)C(=O)OCC
InChIKey
InChIKey=FKSZCIRVLKYUIQ-UHFFFAOYSA-N
Formula
C21H27N3O9S
Mass
497.52
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Hydropyridines
- Level 5 Dihydropyridines
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Subclass
Hydropyridines
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Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Hydropyridines
Intermediate Tree Nodes
Dihydropyridines
Direct Parent
Dihydropyridinecarboxylic acids and derivatives
Alternative Parents
Tricarboxylic acids and derivatives Thiazolidinediones Vinylogous amides Enoate esters Dicarboximides Thiocarbamic acid derivatives Secondary carboxylic acid amides Amino acids and derivatives Enamines Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Tricarboxylic acid or derivatives - Thiazolidinedione - Dicarboximide - Thiazolidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Thiocarbamic acid derivative - Secondary amine - Enamine - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dihydropyridinecarboxylic acids and derivatives. These are compounds containing a dihydropyridine moiety bearing a carboxylic acid group.
External Descriptors
Not available