Compound Identification
SMILES
CO[C@H]1OC(=O)C2=C1[C@]1(C)CC[C@@H]3[C@](C)(CCC[C@]3(C)C(O)=O)[C@H]1CC2
InChIKey
InChIKey=APEVQNKHLPKOPW-SOEYYFHNSA-N
Formula
C21H30O5
Mass
362.466
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
Isocopalane and spongiane diterpenoids 4-carboxy steroids 17-oxosteroids Oxasteroids and derivatives Dicarboxylic acids and derivatives Butenolides Enoate esters Lactones Oxacyclic compounds Carboxylic acids Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Diterpene lactone - 4-carboxy steroid - Steroid acid - Diterpenoid - Spongiane diterpenoid - Oxosteroid - 17-oxosteroid - Steroid - 16-oxasteroid - 2-furanone - Dicarboxylic acid or derivatives - Dihydrofuran - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Lactone - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen 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