Compound Identification
SMILES
COC1=CC=C(NC(=O)CCNCCCOCCOCCOCCCNC(=O)CN(C)C(=O)CCCC[C@@H]2SCC3NC(=O)NC23)C=C1
InChIKey
InChIKey=UGGAXMAEEZXHAE-PFOYYZJDSA-N
Formula
C33H54N6O8S
Mass
694.89
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
Beta amino acids and derivatives Alpha amino acids and derivatives Anilides Methoxyanilines Thienoimidazolidines Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Alkyl aryl ethers N-acyl amines Imidazolidinones Thiophenes Thiolanes Tertiary carboxylic acid amides Ureas Tertiary amines Secondary carboxylic acid amides Azacyclic compounds Dialkyl ethers Dialkylamines Dialkylthioethers Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biotin_derivative - Beta amino acid or derivatives - Alpha-amino acid or derivatives - Methoxyaniline - Anilide - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Thienoimidazolidine - N-arylamide - Alkyl aryl ether - Monocyclic benzene moiety - N-acyl-amine - Benzenoid - Imidazolidinone - Tertiary carboxylic acid amide - Thiolane - Thiophene - Imidazolidine - Amino acid or derivatives - Carboxamide group - Urea - Tertiary amine - Secondary carboxylic acid amide - Secondary amine - Azacycle - Dialkylthioether - Carboxylic acid derivative - Dialkyl ether - Secondary aliphatic amine - Ether - Thioether - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - 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