Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCC1=C(C[C@H]2[C@H]3CC[C@@H](O3)[C@H]2C2=NC(=CO2)C(O)=O)C=C(F)C=C1

InChIKey

InChIKey=FDGGXWWOJZBUMS-WFEDQXDTSA-N

Formula

C21H22FNO6

Mass

403.406

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Oxazoles

Intermediate Tree Nodes

Not available

Direct Parent

2,4-disubstituted oxazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2,4-disubstituted 1,3-oxazole - Fatty acid ester - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Fatty acyl - Benzenoid - Heteroaromatic compound - Methyl ester - Oxolane - Carboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organopnictogen compound - Organic oxide - Carbonyl group - Organooxygen compound - Organohalogen compound - Organofluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2,4-disubstituted oxazoles. These are compounds containing an oxazole ring substituted at positions 2 and 4 only. Oxazole is a five-membered aromatic heterocycle with one oxygen, one nitrogen, and three carbon atoms. Isomers include 1,2-oxazole and 1,3-oxazole.

External Descriptors

Not available

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