Compound Identification
SMILES
N=C1N(C=NC2=C1C(=C(N2CC1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1CCC(CC1)OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12
InChIKey
InChIKey=FDGSKVOQVDWUQM-XHUXRPGMSA-N
Formula
C41H44N6O3S
Mass
700.9
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
Diphenylpyrroles Pyrrolo[2,3-d]pyrimidines Thienoimidazolidines Fatty acid esters Pyrimidines and pyrimidine derivatives Benzene and substituted derivatives Imidolactams Imidazolidinones Thiolanes Thiophenes Heteroaromatic compounds Carboxylic acid esters Ureas Azacyclic compounds Dialkylthioethers Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biotin_derivative - Biotin - 2,3-diphenylpyrrole - 2-phenylpyrrole - 3-phenylpyrrole - Pyrrolo[2,3-d]pyrimidine - Pyrrolopyrimidine - Thienoimidazolidine - Fatty acid ester - Monocyclic benzene moiety - Imidazolidinone - Pyrimidine - Fatty acyl - Substituted pyrrole - Imidolactam - Benzenoid - Pyrrole - Thiophene - Thiolane - Heteroaromatic compound - Imidazolidine - Carboxylic acid ester - Urea - Dialkylthioether - Azacycle - Thioether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - 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