Structure Information
Structure

Compound Identification

SMILES

NC1=C(C(O)=O)C(=O)[C@H]2O[C@H]2[C@H]1O

InChIKey

InChIKey=ATFAXYSVQZKZQN-JKUQZMGJSA-N

Formula

C7H7NO5

Mass

185.135

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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 - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Cyclohexenone - Vinylogous amide - Amino acid or derivatives - Secondary alcohol - Amino acid - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Enamine - Oxirane - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Primary aliphatic amine - Amine - Organonitrogen compound - Primary amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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