Structure Information
Structure

Compound Identification

SMILES

OC[C@@H]1CC[C@@H](O1)N1C=NC(=C1)C(=O)NCCCCNC(=O)CCCCCNC(=O)CCCCC1SC[C@H]2NC(=O)N[C@@H]12

InChIKey

InChIKey=XKPBLIDZZNDAMB-CIZSJGHKSA-N

Formula

C29H47N7O6S

Mass

621.8

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Biotin_derivative - 2-heteroaryl carboxamide - Thienoimidazolidine - Imidazole-4-carbonyl group - Fatty amide - Imidazolidinone - N-acyl-amine - N-substituted imidazole - Fatty acyl - Azole - Imidazole - Imidazolidine - Heteroaromatic compound - Oxolane - Thiolane - Thiophene - Vinylogous amide - Urea - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Dialkylthioether - Oxacycle - Thioether - Azacycle - Primary alcohol - Organic oxide - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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

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