Compound Identification
SMILES
CC(C)(CO)CO.O=C1OC(=O)C=C1.OC(=O)\C=C\C(O)=O
InChIKey
InChIKey=CBWIOIGIPDCELB-JITBQSAISA-N
Formula
C13H18O9
Mass
318.278
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Dihydrofurans
-
Subclass
Furanones
- Level 5 Butenolides
-
Subclass
Furanones
-
Class
Dihydrofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Dihydrofurans
Subclass
Furanones
Intermediate Tree Nodes
Not available
Direct Parent
Butenolides
Alternative Parents
Unsaturated fatty acids Dicarboxylic acids and derivatives Carboxylic acid anhydrides Oxacyclic compounds Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
2-furanone - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Fatty acid - Fatty acyl - Carboxylic acid anhydride - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organic oxide - Alcohol - Carbonyl group - Organic oxygen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as butenolides. These are dihydrofurans with a carbonyl group at the C2 carbon atom.
External Descriptors
Not available