Compound Identification
SMILES
COC(=O)CCCC1=CC=CC2=C1O[C@H]1C[C@H]3OC(C)OC[C@@H]3[C@@H]21
InChIKey
InChIKey=MLDFAVICQXJJFG-FYYGBJPPSA-N
Formula
C19H24O5
Mass
332.396
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Coumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Coumarans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarans
Alternative Parents
Fatty acid methyl esters Alkyl aryl ethers Benzenoids 1,3-dioxanes Methyl esters Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaran - Alkyl aryl ether - Fatty acid ester - Fatty acid methyl ester - Meta-dioxane - Fatty acyl - Benzenoid - Methyl ester - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Ether - Oxacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring.
External Descriptors
Not available