Compound Identification
SMILES
CCCOC(=O)C1=C(NC(=O)[C@H]2[C@H]3CC[C@H](O3)[C@@H]2C([O-])=O)SC=C1C1=C(C)C=C(C)C=C1
InChIKey
InChIKey=NJNHMQHWMOVCTF-UMGGQSCQSA-M
Formula
C24H26NO6S
Mass
456.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Thiophene carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiophene carboxylic acids and derivatives
Alternative Parents
m-Xylenes N-arylamides Dicarboxylic acids and derivatives Vinylogous amides Oxolanes Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Carboxylic acid salts Oxacyclic compounds Carboxylic acids Dialkyl ethers Organopnictogen compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Thiophene carboxylic acid or derivatives - M-xylene - Xylene - N-arylamide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Oxolane - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid salt - Secondary carboxylic acid amide - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxylic acids and derivatives. These are compounds containing a thiophene ring which bears a carboxylic acid group (or a salt/ester thereof).
External Descriptors
Not available