Compound Identification
SMILES
[H]\C(CCC1=CC(=C)OC1=O)=C(\C)CC\C([H])=C(\CCC=C(C)C)C(O)=O
InChIKey
InChIKey=WNZIQVGGRQXNAH-YIAMBQCRSA-N
Formula
C21H28O4
Mass
344.451
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
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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
Diterpenoids Medium-chain fatty acids Methyl-branched fatty acids Heterocyclic fatty acids Unsaturated fatty acids Dicarboxylic acids and derivatives Butenolides Enol esters Enoate esters Lactones Oxacyclic compounds Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Diterpene lactone - Diterpenoid - Medium-chain fatty acid - Branched fatty acid - Methyl-branched fatty acid - Heterocyclic fatty acid - 2-furanone - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Unsaturated fatty acid - Dihydrofuran - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Enol ester - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Oxacycle - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organooxygen compound - Organic oxygen compound - Aliphatic heteromonocyclic 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