Compound Identification
SMILES
COC(=O)C1=C(CCCO)OC(=C1)C1OC1(C)C
InChIKey
InChIKey=KQZOUSJRQPRPSY-UHFFFAOYSA-N
Formula
C13H18O5
Mass
254.282
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
-
Level 5
Heterocyclic fatty acids
- Level 6 Furanoid fatty acids
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Level 5
Heterocyclic 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
Heterocyclic fatty acids
Direct Parent
Furanoid fatty acids
Alternative Parents
Furoic acid esters Furan-3-carboxylic acid esters Hydroxy fatty acids Methyl esters Heteroaromatic compounds Oxacyclic compounds Epoxides Dialkyl ethers Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Furanoid fatty acid - Furoic acid ester - Furoic acid or derivatives - Furan-3-carboxylic acid ester - Furan-3-carboxylic acid or derivatives - Hydroxy fatty acid - Heteroaromatic compound - Methyl ester - Furan - Carboxylic acid ester - Carboxylic acid derivative - Dialkyl ether - Oxacycle - Organoheterocyclic compound - Oxirane - Ether - Alcohol - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as furanoid fatty acids. These are fatty acids containing a 5-alkylfuran-2-alkanoic acid.
External Descriptors
Not available