Compound Identification
SMILES
CCCCC\C=C/C[C@@]1(O)C=C(Cl)C(=O)\C1=C/C=C\CCCC(=O)OC
InChIKey
InChIKey=CTIZPKYMYVPNGA-RAUOOXNLSA-N
Formula
C21H29ClO4
Mass
380.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Eicosanoids
- Level 5 Clavulones and derivatives
-
Subclass
Eicosanoids
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Eicosanoids
Intermediate Tree Nodes
Not available
Direct Parent
Clavulones and derivatives
Alternative Parents
Fatty acid methyl esters Tertiary alcohols Methyl esters Alpha-chloroketones Cyclic ketones Vinyl chlorides Monocarboxylic acids and derivatives Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Clavulone - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Alpha-chloroketone - Tertiary alcohol - Methyl ester - Cyclic ketone - Carboxylic acid ester - Ketone - Chloroalkene - Haloalkene - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Vinyl chloride - Vinyl halide - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organooxygen compound - Carbonyl group - Organic oxygen compound - Alcohol - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as clavulones and derivatives. These are ester derivatives of prostanoids.
External Descriptors
LIPIDMAPS (LMFA03120011) : Clavulones and derivatives