Compound Identification
SMILES
CCOC(=O)C(=N\OC1CCCC1)\[C@@H](O)CBr
InChIKey
InChIKey=COXDIAMOSPJYQX-CVZWZAMJSA-N
Formula
C11H18BrNO4
Mass
308.172
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Hydroxy acids and derivatives
- Subclass Beta hydroxy acids and derivatives
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Class
Hydroxy acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Hydroxy acids and derivatives
Subclass
Beta hydroxy acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Beta hydroxy acids and derivatives
Alternative Parents
Fatty acid esters Secondary alcohols Oxime ethers Carboxylic acid esters Bromohydrins Monocarboxylic acids and derivatives Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Beta-hydroxy acid - Fatty acid ester - Fatty acyl - Bromohydrin - Carboxylic acid ester - Halohydrin - Oxime ether - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Alkyl bromide - Organic oxygen compound - Carbonyl group - Alcohol - Organooxygen compound - Alkyl halide - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta hydroxy acids and derivatives. These are compounds containing a carboxylic acid substituted with a hydroxyl group on the C3 carbon atom.
External Descriptors
Not available