Structure Information
Structure

Compound Identification

SMILES

CC(C)N1C(\C=C\[C@H](O)C[C@H](O)CC(O)=O)=C(C2=CC=CC=C12)C1=CC=C(F)C=C1.COC1=C(OC)C(C2=CC=CC=N2)=C2C(N)=NC(=NC2=C1)N1CCC2=C(C1)C=CC=C2NS(C)(=O)=O

InChIKey

InChIKey=OBSPUAMEHIUECT-BTZVDUIBSA-N

Formula

C49H52FN7O8S

Mass

918.05

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroles

Subclass

Substituted pyrroles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrroles

Alternative Parents

Molecular Framework

Not available

Substituents

3-phenylpyrrole - Quinazolinamine - N-alkylindole - Quinazoline - Sulfanilide - Tetrahydroisoquinoline - Indole - Indole or derivatives - Medium-chain hydroxy acid - Anisole - Phenol ether - Medium-chain fatty acid - Dialkylarylamine - Aminopyrimidine - Hydroxy fatty acid - Heterocyclic fatty acid - Halogenated fatty acid - Halobenzene - Fluorobenzene - Beta-hydroxy acid - Alkyl aryl ether - Unsaturated fatty acid - Hydroxy acid - Fatty acid - Organosulfonic acid amide - Organic sulfonic acid amide - Monocyclic benzene moiety - Fatty acyl - Imidolactam - Pyrimidine - Pyridine - Benzenoid - Aryl fluoride - Aryl halide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Secondary alcohol - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Primary amine - Amine - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organohalogen compound - Alcohol - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.

External Descriptors

Not available

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