Compound Identification
SMILES
OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N([C@H]12)C1=CC=C([18F])C=C1
InChIKey
InChIKey=XRHNMIAPNYUYIN-AATGUCIKSA-N
Formula
C16H19FN2O3S
Mass
337.4
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
Phenylimidazolidines Medium-chain fatty acids Thienoimidazolidines Fluorobenzenes Halogenated fatty acids Heterocyclic fatty acids Thia fatty acids Imidazolidinones Aryl fluorides Thiophenes Thiolanes Ureas Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Carboxylic acids Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biotin_derivative - Biotin - Phenylimidazolidine - Thienoimidazolidine - Medium-chain fatty acid - Fluorobenzene - Halobenzene - Halogenated fatty acid - Heterocyclic fatty acid - Thia fatty acid - Fatty acyl - Fatty acid - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Imidazolidinone - Thiophene - Thiolane - Imidazolidine - Urea - Carbonic acid derivative - Azacycle - Thioether - Dialkylthioether - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organic oxygen compound - Organohalogen compound - Aromatic 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