Compound Identification
SMILES
CC(C)C(CCC(=C)C1CCC(=O)O1)C=CC(C)(O)CC(O)=O
InChIKey
InChIKey=LXDMRAQTUIZMLS-UHFFFAOYSA-N
Formula
C18H28O5
Mass
324.417
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Terpene lactones
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Terpene lactones
Intermediate Tree Nodes
Not available
Direct Parent
Terpene lactones
Alternative Parents
Sesquiterpenoids Medium-chain hydroxy acids and derivatives Medium-chain fatty acids Heterocyclic fatty acids Hydroxy fatty acids Methyl-branched fatty acids Dicarboxylic acids and derivatives Gamma butyrolactones Unsaturated fatty acids Tetrahydrofurans Tertiary alcohols Carboxylic acid esters Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Terpene lactone - Sesquiterpenoid - Medium-chain hydroxy acid - Medium-chain fatty acid - Branched fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Methyl-branched fatty acid - Dicarboxylic acid or derivatives - Gamma butyrolactone - Fatty acyl - Fatty acid - Unsaturated fatty acid - Tertiary alcohol - Tetrahydrofuran - Lactone - Carboxylic acid ester - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Carbonyl group - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring.
External Descriptors
Not available