Structure Information
Structure

Compound Identification

SMILES

CC1(C)CC[C@@]2(CC[C@]3(C)[C@@H]([C@@H]2C1)C(=O)C=C1[C@@]2(C)CC(C#N)=C(O)C(C)(C)[C@@H]2CC[C@@]31C)C(=O)NCCCCCCNC(=O)CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]12

InChIKey

InChIKey=HUTMONJPUMYBDO-PDJAEKNUSA-N

Formula

C47H71N5O5S

Mass

818.18

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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

Aliphatic heteropolycyclic compounds

Substituents

Biotin_derivative - 2-naphthalenecarboxamide - Thienoimidazolidine - Cyclohexenone - Fatty amide - Imidazolidinone - Fatty acyl - N-acyl-amine - Imidazolidine - Thiophene - Thiolane - Carboxamide group - Ketone - Urea - Secondary carboxylic acid amide - Carboxylic acid derivative - Enol - Azacycle - Dialkylthioether - Thioether - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Cyanide - Organonitrogen compound - Organooxygen 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

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