Compound Identification
SMILES
C\C=C(\C)C(=O)O[C@H]1[C@H]2[C@H](C[C@@H](C)[C@@H]3[C@@H](O)C[C@@H](OC(=O)CC(C)C)[C@@]13C)OC(=O)C2=C
InChIKey
InChIKey=MLTRRVPOGLBRTK-GSOHFQGPSA-N
Formula
C25H36O7
Mass
448.556
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 Sesquiterpene 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
Sesquiterpene lactones
Alternative Parents
Ambrosanolides and secoambrosanolides Pseudoguaianes Tricarboxylic acids and derivatives Fatty acid esters Gamma butyrolactones Tetrahydrofurans Enoate esters Secondary alcohols Cyclic alcohols and derivatives Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Helenalin-skeleton - Ambrosanolide - Pseudoguaiane sesquiterpenoid - Sesquiterpenoid - Tricarboxylic acid or derivatives - Fatty acid ester - Gamma butyrolactone - Fatty acyl - Cyclic alcohol - Alpha,beta-unsaturated carboxylic ester - Tetrahydrofuran - Enoate ester - Secondary alcohol - Lactone - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as sesquiterpene lactones. These are sesquiterpenoids containing a lactone ring.
External Descriptors
Not available