Compound Identification
SMILES
COC(=O)C1=C/C2OC(=O)C(C)C2(O)[C@H](OC(C)=O)C2[C@@H](C)C(CC(OC(C)=O)[C@]2(C)[C@@H](CC\1)OC(C)=O)OC(C)=O
InChIKey
InChIKey=VXLRUARRHGRFLY-ALOSRTMXSA-N
Formula
C29H40O13
Mass
596.626
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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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
Hexacarboxylic acids and derivatives Briarane diterpenoids Gamma butyrolactones Tetrahydrofurans Tertiary alcohols Methyl esters Enoate esters Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Diterpene lactone - Diterpenoid - Hexacarboxylic acid or derivatives - Briarane diterpenoid - Gamma butyrolactone - Tertiary alcohol - Tetrahydrofuran - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Alcohol - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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