Compound Identification
SMILES
COC(=O)C1=C(C=C(S1)C1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1)N(C(C)C)C(=O)C1CCC(C)CC1
InChIKey
InChIKey=VMWZMSYUOCNIKN-UHFFFAOYSA-N
Formula
C29H40BNO5S
Mass
525.51
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
2,3,5-trisubstituted thiophenes Benzene and substituted derivatives Vinylogous amides Tertiary carboxylic acid amides Boronic acid esters Methyl esters Dioxaborolanes Heteroaromatic compounds Tertiary amines Amino acids and derivatives Oxacyclic compounds Organic metalloid salts Organometalloid compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Monocyclic benzene moiety - Benzenoid - Boronic acid ester - 1,3,2-dioxaborolane - Tertiary carboxylic acid amide - Heteroaromatic compound - Methyl ester - Vinylogous amide - Amino acid or derivatives - Boronic acid derivative - Carboxamide group - Carboxylic acid ester - Tertiary amine - Carboxylic acid derivative - Oxacycle - Organic metalloid salt - Organonitrogen compound - Organic metalloid moeity - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic 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