Compound Identification
SMILES
CC(C)(C)OC(=O)NC(CCCCNC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC12)C(O)=O
InChIKey
InChIKey=LPJWUKCJHUOTJU-UHFFFAOYSA-N
Formula
C27H47N5O7S
Mass
585.76
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 acids and derivatives Thienoimidazolidines Medium-chain fatty acids Branched fatty acids Heterocyclic fatty acids N-acyl amines Imidazolidinones Thiophenes Thiolanes Carbamate esters Ureas Secondary carboxylic acid amides Dialkylthioethers Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Biotin_derivative - Alpha-amino acid or derivatives - Medium-chain fatty acid - Thienoimidazolidine - Branched fatty acid - Heterocyclic fatty acid - Fatty amide - Fatty acyl - Fatty acid - Imidazolidinone - N-acyl-amine - Imidazolidine - Carbamic acid ester - Thiophene - Thiolane - Carboxamide group - Urea - Secondary carboxylic acid amide - Thioether - Monocarboxylic acid or derivatives - Dialkylthioether - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen 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