Compound Identification
SMILES
CC12COC(CCCCCCCCC\C=C/CCCCCCCCCC(O)=O)(OC1)OC2
InChIKey
InChIKey=XTZHLGUHLJYWGQ-IHWYPQMZSA-N
Formula
C27H48O5
Mass
452.676
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Very long-chain fatty acids
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Subclass
Fatty acids and conjugates
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acids and conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Very long-chain fatty acids
Alternative Parents
Ortho esters Heterocyclic fatty acids Carboxylic acid orthoesters Unsaturated fatty acids 1,3-dioxanes Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Very long-chain fatty acid - Carboxylic acid orthoester - Heterocyclic fatty acid - Ortho ester - Unsaturated fatty acid - Meta-dioxane - Orthocarboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as very long-chain fatty acids. These are fatty acids with an aliphatic tail that contains at least 22 carbon atoms.
External Descriptors
Not available