Compound Identification
SMILES
CC1CCC(CC2(C)C1CCC2=O)C(=C)C(O)=O
InChIKey
InChIKey=CRXWIWHBLVNJSP-UHFFFAOYSA-N
Formula
C15H22O3
Mass
250.338
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Sesquiterpenoids
- Level 5 Pseudoguaianes
-
Subclass
Sesquiterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Pseudoguaianes
Alternative Parents
Ketones Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Pseudoguaiane sesquiterpenoid - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as pseudoguaianes. These are sesquiterpenoids with a structure based on the pseudoguaiane skeleton, which arises by the migration of the a methyl group of the bicyclic guaiane skeleton from the C4 to the C5 position.
External Descriptors
Not available