Compound Identification
SMILES
CCCC(=O)SC1C(=O)CC(C)(C)OC1=O
InChIKey
InChIKey=PTZILSPNJPBFPQ-UHFFFAOYSA-N
Formula
C11H16O4S
Mass
244.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactones
- Subclass Delta valerolactones
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Class
Lactones
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactones
Subclass
Delta valerolactones
Intermediate Tree Nodes
Not available
Direct Parent
Delta valerolactones
Alternative Parents
Fatty acyl thioesters Oxanes 1,3-dicarbonyl compounds Thioesters Cyclic ketones Carboxylic acid esters Carbothioic S-esters Sulfenyl compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Delta valerolactone - Delta_valerolactone - Fatty acyl thioester - Oxane - 1,3-dicarbonyl compound - Carboxylic acid ester - Ketone - Thiocarboxylic acid ester - Carbothioic s-ester - Cyclic ketone - Thiocarboxylic acid or derivatives - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Sulfenyl compound - Oxacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.
External Descriptors
Not available