Compound Identification
SMILES
COC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2C\C=C\C
InChIKey
InChIKey=XRKKCKQLZFNJJH-JPWDYYAESA-N
Formula
C15H24N2O3S
Mass
312.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Biotin and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Biotin and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Biotin and derivatives
Alternative Parents
Thienoimidazolidines Fatty acid methyl esters Imidazolidinones Thiophenes Thiolanes Methyl esters Ureas Monocarboxylic acids and derivatives Dialkylthioethers Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Biotin_derivative - Biotin - Thienoimidazolidine - Fatty acid ester - Fatty acid methyl ester - Fatty acyl - Imidazolidinone - Imidazolidine - Methyl ester - Thiophene - Thiolane - Carboxylic acid ester - Urea - Carboxylic acid derivative - Azacycle - Dialkylthioether - Monocarboxylic acid or derivatives - Thioether - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as biotin and derivatives. These are organic compounds containing a ureido (tetrahydroimidizalone) ring fused with a tetrahydrothiophene ring.
External Descriptors
Not available