Compound Identification
SMILES
C[C@H]1O[C@H]1\C=C\C(=O)[C@]1(O)[C@@H](CO)COC1=O
InChIKey
InChIKey=NDWZCKPIOWDQOR-WTCWJIQASA-N
Formula
C11H14O6
Mass
242.227
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactones
- Subclass Gamma butyrolactones
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Class
Lactones
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactones
Subclass
Gamma butyrolactones
Intermediate Tree Nodes
Not available
Direct Parent
Gamma butyrolactones
Alternative Parents
Tertiary alcohols Oxolanes Enones Alpha-hydroxy ketones Acryloyl compounds Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Primary alcohols Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Gamma butyrolactone - Acryloyl-group - Alpha-hydroxy ketone - Enone - Oxolane - Tertiary alcohol - Alpha,beta-unsaturated ketone - Ketone - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Oxirane - Dialkyl ether - Organic oxide - Aldehyde - Organic oxygen compound - Organooxygen compound - Primary alcohol - Alcohol - Carbonyl group - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as gamma butyrolactones. These are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.
External Descriptors
Not available