Compound Identification
SMILES
COC(=O)C(\C)=C\CC1=CC2=C(OC1=O)C(O)=C(OC)C=C2
InChIKey
InChIKey=KXEJCMRLSGMAAK-RUDMXATFSA-N
Formula
C16H16O6
Mass
304.298
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
- Subclass Hydroxycoumarins
-
Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Hydroxycoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Hydroxycoumarins
Alternative Parents
1-benzopyrans Anisoles Pyranones and derivatives Fatty acid esters Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Methyl esters Heteroaromatic compounds Enoate esters Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydroxycoumarin - Benzopyran - 1-benzopyran - Anisole - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Fatty acid ester - Pyranone - Fatty acyl - Pyran - Benzenoid - Methyl ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Heteroaromatic compound - Lactone - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Ether - Organic oxide - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the coumarin skeleton.
External Descriptors
Not available