Compound Identification
SMILES
COC(=O)CCC\C=C/C[C@H](OC(=O)C1=CC=CC=C1)\C=C\[C@@H]1O[C@H]1C\C=C/CCCCC=O
InChIKey
InChIKey=DBIWRACPRDNMRP-BROWVNJOSA-N
Formula
C28H36O6
Mass
468.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
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Subclass
Eicosanoids
- Level 5 Hepoxilins
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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
Hepoxilins
Alternative Parents
Benzoic acid esters Benzoyl derivatives Fatty acid methyl esters Methyl esters Alpha-hydrogen aldehydes Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hepoxilin - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Fatty acid ester - Fatty acid methyl ester - Benzenoid - Monocyclic benzene moiety - Alpha-hydrogen aldehyde - Methyl ester - Carboxylic acid ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Aldehyde - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hepoxilins. These are eicosanoids containing an oxirane group attached to the fatty acyl chain.
External Descriptors
Not available