Compound Identification
SMILES
CC(C)(COC1CCOCC1)C#CC1=CC(NC2CCC(CC2)OC2=CC=CC=N2)=C(S1)C(O)=O
InChIKey
InChIKey=YZNKIGCUDVDXRP-UHFFFAOYSA-N
Formula
C27H34N2O5S
Mass
498.64
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
-
Subclass
Thiophene carboxylic acids and derivatives
- Level 5 Thiophene carboxylic acids
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Subclass
Thiophene carboxylic acids and derivatives
-
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
Alternative Parents
2,3,5-trisubstituted thiophenes Secondary alkylarylamines Alkyl aryl ethers Cyclohexylamines Pyridines and derivatives Oxanes Aminothiophenes Vinylogous amides Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Dialkyl ethers Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2,3,5-trisubstituted thiophene - Thiophene carboxylic acid - Alkyl aryl ether - Cyclohexylamine - Secondary aliphatic/aromatic amine - Aminothiophene - Oxane - Pyridine - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Secondary amine - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxylic acids. These are compounds containing a thiophene ring which bears a carboxylic acid group.
External Descriptors
Not available