Compound Identification
SMILES
CCCCC\C=C/C[C@@]1(O)C=C(Cl)C(=O)\C1=C/[C@H](OC(C)=O)[C@H](CCCC(=O)OC)OC(C)=O
InChIKey
InChIKey=HMDYASDJIREJJW-HAUBZSQNSA-N
Formula
C25H35ClO8
Mass
499.0
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
Tricarboxylic acids and derivatives Fatty acid methyl esters Tertiary alcohols Methyl esters Alpha-chloroketones Cyclic ketones Vinyl chlorides Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Clavulone - Tricarboxylic acid or derivatives - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Tertiary alcohol - Alpha-chloroketone - Methyl ester - Cyclic ketone - Carboxylic acid ester - Ketone - Chloroalkene - Carboxylic acid derivative - Vinyl halide - Vinyl chloride - Haloalkene - Hydrocarbon derivative - Organohalogen compound - Organochloride - Alcohol - Organic oxygen compound - Organooxygen compound - Organic oxide - Carbonyl group - 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 (LMFA03120037) : Clavulones and derivatives