Compound Identification
SMILES
CC\C=C/C\C=C/C[C@@]1(O)C=C(Br)C(=O)\C1=C/[C@H](O)[C@H](O)CCCC(=O)OC
InChIKey
InChIKey=VBOZWGQLSKGGMY-YAUVGBBRSA-N
Formula
C21H29BrO6
Mass
457.361
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
Fatty acid methyl esters Tertiary alcohols Methyl esters Alpha-haloketones Secondary alcohols Cyclic ketones 1,2-diols Vinyl bromides Monocarboxylic acids and derivatives Bromoalkenes Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
Clavulone - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Tertiary alcohol - Methyl ester - 1,2-diol - Carboxylic acid ester - Ketone - Secondary alcohol - Cyclic ketone - Monocarboxylic acid or derivatives - Vinyl bromide - Vinyl halide - Bromoalkene - Haloalkene - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Alcohol - 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
Not available