Compound Identification
SMILES
CCC(=O)O[C@H]1C[C@@H](OC(C)=O)\C(C)=C/[C@@H]2OC(=O)[C@]3(C)O[C@@]23[C@@H](OC(C)=O)[C@H]2[C@@]3(C)O[C@H]3C[C@H](OC(C)=O)[C@]12C
InChIKey
InChIKey=SQOBPFDVGGDHQT-QRBIUABJSA-N
Formula
C29H38O12
Mass
578.611
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Terpene lactones
- Level 5 Diterpene lactones
-
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 Pentacarboxylic acids and derivatives Oxepanes Gamma butyrolactones 1,4-dioxanes Tetrahydrofurans Carboxylic acid esters Oxacyclic compounds Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Briarane diterpenoid - Diterpenoid - Diterpene lactone - Pentacarboxylic acid or derivatives - Oxepane - Gamma butyrolactone - Para-dioxane - Tetrahydrofuran - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - 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