Structure Information
Structure

Compound Identification

SMILES

C[C@H]1OC(=O)N[C@@]11[C@H](N)[C@@H](NC2=CC=CC(=C2)C(C)=O)[C@@](O)(COC(=O)C2=C(C)C=CC=C2O)[C@@]1(C)O

InChIKey

InChIKey=GRYVVIDCTCRLJM-BXSXBJHJSA-N

Formula

C26H31N3O8

Mass

513.547

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alkyl-phenylketone - O-hydroxybenzoic acid ester - Aromatic monoterpenoid - Benzoate ester - 11-noriridane monoterpenoid - Monoterpenoid - Salicylic acid or derivatives - Acetophenone - Benzoic acid or derivatives - Benzoyl - M-cresol - Phenylalkylamine - Aniline or substituted anilines - Aryl alkyl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Secondary aliphatic/aromatic amine - Toluene - Benzenoid - Monocyclic benzene moiety - Oxazolidinone - Vinylogous acid - Carbamic acid ester - Tertiary alcohol - Oxazolidine - Cyclic alcohol - Amino acid or derivatives - 1,2-aminoalcohol - 1,2-diol - Carboxylic acid ester - Carbonic acid derivative - Carboxylic acid derivative - Organoheterocyclic compound - Secondary amine - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Amine - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Alcohol - Primary aliphatic amine - Primary amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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