Compound Identification
SMILES
COC(=O)[C@H]1[C@H]2[C@@]3(CCC(=O)[C@]2(COCC2=CC=CC=C2)C(=O)O3)[C@@H]2CC[C@@H]3C[C@]12CC3=O
InChIKey
InChIKey=LDAKEQNRFNSCPH-YIRZYEGMSA-N
Formula
C26H28O7
Mass
452.503
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 Benzylethers Oxepanes Gamma butyrolactones Dicarboxylic acids and derivatives Oxolanes Methyl esters Ketones Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Terpene lactone - Sesquiterpenoid - Benzylether - Caprolactone - Oxepane - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Gamma butyrolactone - Benzenoid - Methyl ester - Oxolane - Carboxylic acid ester - Ketone - Lactone - Organoheterocyclic compound - Ether - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Aldehyde - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic 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