Compound Identification
SMILES
CC\C=C/C\C=C/C[C@@]1(O)[C@H]2O[C@@]2(Cl)C(=O)\C1=C\[C@H](OC(C)=O)[C@H](CCCC(=O)OC)OC(C)=O
InChIKey
InChIKey=ZXSDFJZDMJBPKR-OHUDOUDKSA-N
Formula
C25H33ClO9
Mass
512.98
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Fatty Acyls
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Subclass
Eicosanoids
- Level 5 Clavulones and derivatives
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Subclass
Eicosanoids
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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 Oxanes Tertiary alcohols Methyl esters Alpha-chloroketones Cyclic alcohols and derivatives Oxacyclic compounds Epoxides Dialkyl ethers Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Clavulone - Tricarboxylic acid or derivatives - Fatty acid ester - Fatty acid methyl ester - Oxane - Alpha-haloketone - Cyclic alcohol - Tertiary alcohol - Methyl ester - Alpha-chloroketone - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Oxirane - Ether - Organooxygen compound - Alcohol - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Carbonyl group - Alkyl halide - Alkyl chloride - Aliphatic heteropolycyclic 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 (LMFA03120039) : Clavulones and derivatives