Compound Identification
SMILES
CCCCC\C=C/C[C@@]1(O)C=C(Cl)C(=O)[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](CCCC(=O)OC)OC(C)=O
InChIKey
InChIKey=JJPYFSVYYQRFTK-BWCUSQEASA-N
Formula
C27H39ClO10
Mass
559.05
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Eicosanoids
- Level 5 Clavulones and derivatives
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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
Punaglandins and related compounds Tetracarboxylic 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
Punaglandin skeleton - Clavulone - Prostaglandin skeleton - Tetracarboxylic acid or derivatives - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Methyl ester - Alpha-chloroketone - Tertiary alcohol - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Organohalogen compound - Alcohol - Carbonyl group - Organochloride - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - 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 (LMFA03120029) : Clavulones and derivatives