Compound Identification
SMILES
OC(CNCCNC(=O)CCCCC1SCC2NC(=O)NC12)COC1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=PMLCWCLNAKFIMB-UHFFFAOYSA-N
Formula
C25H34N4O4S
Mass
486.63
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
Naphthalenes Thienoimidazolidines Phenol ethers Alkyl aryl ethers Imidazolidinones N-acyl amines Thiophenes Thiolanes 1,2-aminoalcohols Ureas Amino acids and derivatives Secondary carboxylic acid amides Secondary alcohols Dialkylamines Dialkylthioethers Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biotin_derivative - Naphthalene - Phenol ether - Thienoimidazolidine - Alkyl aryl ether - N-acyl-amine - Imidazolidinone - Benzenoid - Fatty amide - Fatty acyl - Thiolane - Imidazolidine - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Urea - Amino acid or derivatives - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Dialkylthioether - Thioether - Secondary amine - Alcohol - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - 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