Compound Identification
SMILES
CC1C(=O)OC2C(Cl)C(=C)CCC(OC(C)=O)C3(C)C=CC(=O)C(C)C3C(O)C12O
InChIKey
InChIKey=HENRLMNHFQWNTI-UHFFFAOYSA-N
Formula
C22H29ClO7
Mass
440.92
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
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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
Diterpene lactones
Alternative Parents
Briarane diterpenoids Cyclohexenones Gamma butyrolactones Dicarboxylic acids and derivatives Tetrahydrofurans Tertiary alcohols Secondary alcohols Carboxylic acid esters 1,2-diols Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Diterpene lactone - Diterpenoid - Briarane diterpenoid - Cyclohexenone - Dicarboxylic acid or derivatives - Gamma butyrolactone - Tertiary alcohol - Tetrahydrofuran - 1,2-diol - Carboxylic acid ester - Ketone - Lactone - Secondary alcohol - Cyclic ketone - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organohalogen compound - Organochloride - Organooxygen compound - Alkyl halide - Carbonyl group - 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