Compound Identification
SMILES
CCCCC\C=C/C[C@@]1(OC(C)=O)C=C(Cl)C(=O)\C1=C/[C@H](OC(C)=O)[C@H](CCCC(=O)OC)OC(C)=O
InChIKey
InChIKey=ANXQDHSEXVYWJM-MFZKBGAOSA-N
Formula
C27H37ClO9
Mass
541.03
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
Tetracarboxylic acids and derivatives Fatty acid methyl esters Methyl esters Alpha-chloroketones Cyclic ketones Vinyl chlorides Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Clavulone - Tetracarboxylic acid or derivatives - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Alpha-chloroketone - Methyl ester - Carboxylic acid ester - Ketone - Cyclic ketone - Carboxylic acid derivative - Chloroalkene - Haloalkene - Vinyl chloride - Vinyl halide - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organochloride - Organooxygen compound - Organic oxygen compound - Organic oxide - 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 (LMFA03120038) : Clavulones and derivatives