Structure Information
Structure

Compound Identification

SMILES

CN(CCCNC(=O)CCCCC1SC[C@@H]2NC(=O)N[C@H]12)CCCNC1=C(C=C(C=C1)N=[N+]=[N-])[N+]([O-])=O

InChIKey

InChIKey=BRLRJZRHRJEWJY-JERZPMBSSA-N

Formula

C23H35N9O4S

Mass

533.65

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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 - Nitrobenzene - Thienoimidazolidine - Nitroaromatic compound - Phenylazide - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Imidazolidinone - Fatty acyl - Fatty amide - Monocyclic benzene moiety - Benzenoid - N-acyl-amine - Imidazolidine - Thiophene - Thiolane - Amino acid or derivatives - Azo compound - Azo imide - Carboxamide group - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Urea - Dialkylthioether - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Thioether - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Azacycle - Organic 1,3-dipolar compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic salt - Organonitrogen compound - Organic zwitterion - Amine - 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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