Compound Identification
SMILES
CC\C=C/C\C=C/C[C@@]1(O)C=C(Br)C(=O)[C@@H]1[C@H](O)[C@@H](O)[C@@H](O)CCCC(=O)OC
InChIKey
InChIKey=FFVJHZGMAJLBNH-YAFMCELVSA-N
Formula
C21H31BrO7
Mass
475.376
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
Prostaglandins and related compounds 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 - Prostaglandin skeleton - Fatty acid ester - Fatty acid methyl ester - Alpha-haloketone - Methyl ester - Tertiary alcohol - Carboxylic acid ester - Cyclic ketone - 1,2-diol - Ketone - Secondary alcohol - Carboxylic acid derivative - Bromoalkene - Haloalkene - Vinyl halide - Monocarboxylic acid or derivatives - Polyol - Vinyl bromide - Carbonyl group - Alcohol - Organic oxide - Organohalogen compound - Organobromide - Organooxygen compound - 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
Not available