Compound Identification
SMILES
O=C(CCCCCNOC1=CC=C(C=C1)C1=C(C(=O)N2CCCC2C1)C1=CC=CC=C1)OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12
InChIKey
InChIKey=STXVUDAOSZLOIB-LDAQFECOSA-N
Formula
C36H44N4O6S
Mass
660.83
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
Stilbenes N-alkyl-O-phenylhydroxylamines Thienoimidazolidines Phenoxy compounds Dicarboxylic acids and derivatives Imidazolidinones Carboxylic acid anhydrides Thiophenes Thiolanes Tertiary carboxylic acid amides Pyrrolidines Amino acids and derivatives Ureas Tertiary amines Lactams Dialkylthioethers Azacyclic compounds N-organohydroxylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biotin_derivative - Biotin - Stilbene - N-alkyl-o-phenylhydroxylamine - Phenoxy compound - O-phenylhydroxylamine - Thienoimidazolidine - Imidazolidinone - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Thiophene - Thiolane - Imidazolidine - Tertiary carboxylic acid amide - Pyrrolidine - Carboxylic acid anhydride - Urea - Lactam - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - N-organohydroxylamine - Carboxylic acid derivative - Dialkylthioether - Thioether - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen 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