Structure Information
Structure

Compound Identification

SMILES

COC(C\C=C\Br)\C=C\C(\C)=C\[C@@H](O)[C@H]1CC(C[C@@](O)(CC2=NC(\C=C(/C)[C@@H]3O[C@@H]4C\C=C\C5=NC(=CO5)C5CCCC(C[C@H]6CC(=C)C[C@H](C\C=C/C(=O)O[C@@H]([C@H]4C)[C@H]3C)O6)O5)=CO2)O1)OC

InChIKey

InChIKey=VTCOMGIGQUJTTN-GWPOGLOCSA-N

Formula

C53H71BrN2O12

Mass

1008.057

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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 - Oxane - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Hemiacetal - Lactone - Secondary alcohol - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Vinyl bromide - Vinyl halide - Bromoalkene - Haloalkene - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Alcohol - Organic oxide - Hydrocarbon derivative - 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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