Compound Identification
SMILES
OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)C(O)=O)C(O)=O
InChIKey
InChIKey=JJWXOJQKTMHGLL-CQCRDEEPSA-N
Formula
C41H72N6O18S
Mass
969.11
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
Glutamic acid and derivatives N-carbamoyl-alpha amino acids Tricarboxylic acids and derivatives Thienoimidazolidines Imidazolidinones N-acyl amines Thiophenes Thiolanes Ureas Secondary carboxylic acid amides Azacyclic compounds Dialkylthioethers Dialkyl ethers Carboxylic acids Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Biotin_derivative - Glutamic acid or derivatives - N-carbamoyl-alpha-amino acid or derivatives - N-carbamoyl-alpha-amino acid - Alpha-amino acid or derivatives - Tricarboxylic acid or derivatives - Thienoimidazolidine - Imidazolidinone - Fatty acyl - N-acyl-amine - Fatty amide - Imidazolidine - Thiophene - Thiolane - Urea - Carbonic acid derivative - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Azacycle - Dialkylthioether - Thioether - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen 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