Compound Identification
SMILES
CCCC(=O)OC1C=CC(=C)C(Cl)C2OC(=O)C(C)C2(O)C(OC(C)=O)C2C(C)C(=O)C=CC12C
InChIKey
InChIKey=PECVBLOYWOKDGU-UHFFFAOYSA-N
Formula
C26H33ClO8
Mass
508.99
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Terpene lactones
- Level 5 Diterpene lactones
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Subclass
Terpene lactones
-
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
Diterpene lactones
Alternative Parents
Briarane diterpenoids Tricarboxylic acids and derivatives Fatty acid esters Cyclohexenones Gamma butyrolactones Tetrahydrofurans Tertiary alcohols Carboxylic acid esters Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Diterpene lactone - Diterpenoid - Briarane diterpenoid - Tricarboxylic acid or derivatives - Cyclohexenone - Fatty acid ester - Fatty acyl - Gamma butyrolactone - Tetrahydrofuran - Tertiary alcohol - Carboxylic acid ester - Cyclic ketone - Ketone - Lactone - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Alkyl halide - Organooxygen compound - Organochloride - Organohalogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety.
External Descriptors
Not available