Compound Identification
SMILES
CC1OC1\C=C/C(=O)[C@@]1(O)[C@H](CO)COC1=O
InChIKey
InChIKey=NDWZCKPIOWDQOR-QSCQIRKESA-N
Formula
C11H14O6
Mass
242.227
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactones
- Subclass Gamma butyrolactones
-
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
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Gamma butyrolactone - Acryloyl-group - Alpha-hydroxy ketone - Enone - Alpha,beta-unsaturated ketone - Tertiary alcohol - Oxolane - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Dialkyl ether - Oxacycle - Oxirane - Ether - Monocarboxylic acid or derivatives - Alcohol - Hydrocarbon derivative - Organic oxide - Carbonyl group - Primary alcohol - Organooxygen compound - Organic oxygen compound - 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