Compound Identification
SMILES
[O-]C(=O)C(F)(F)F.COS(=O)(=S)CCNC(=O)C([NH3+])CCCCNC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC12
InChIKey
InChIKey=XOZURMSQFRIGDW-UHFFFAOYSA-N
Formula
C27H47F3N6O8S3
Mass
736.88
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
Alpha amino acid amides Thienoimidazolidines Imidazolidinones N-acyl amines Thiophenes Thiolanes Alpha-halocarboxylic acids Quaternary ammonium salts Ureas Secondary carboxylic acid amides Carboxylic acid salts Dialkylthioethers Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Monoalkylamines Organofluorides Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organic zwitterions Organic oxides
Molecular Framework
Not available
Substituents
Biotin_derivative - Alpha-amino acid amide - Alpha-amino acid or derivatives - Thienoimidazolidine - Fatty acyl - Fatty amide - Imidazolidinone - N-acyl-amine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Imidazolidine - Thiophene - Thiolane - Quaternary ammonium salt - Carboxamide group - Carboxylic acid salt - Urea - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Thioether - Monocarboxylic acid or derivatives - Carboxylic acid - Dialkylthioether - Organic nitrogen compound - Organic zwitterion - Alkyl halide - Primary aliphatic amine - Alkyl fluoride - Organohalogen compound - Carbonyl group - Organofluoride - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur 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