Compound Identification
SMILES
C[C@]12CCC[C@@](C)([C@@H]1CC[C@]1(C)[C@@H]2CCC2=C1C(O)OC2=O)C(O)=O
InChIKey
InChIKey=NEQPMYCWXBJEHW-CRJKIMHZSA-N
Formula
C20H28O5
Mass
348.439
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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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
Isocopalane and spongiane diterpenoids 4-carboxy steroids Hydroxysteroids 17-oxosteroids Oxasteroids and derivatives Dicarboxylic acids and derivatives Butenolides Enoate esters Lactones Hemiacetals Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Diterpene lactone - Diterpenoid - Spongiane diterpenoid - 4-carboxy steroid - Steroid acid - 15-hydroxysteroid - Hydroxysteroid - Oxosteroid - 17-oxosteroid - Steroid - 16-oxasteroid - 2-furanone - Dicarboxylic acid or derivatives - Dihydrofuran - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Hemiacetal - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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