Compound Identification
SMILES
CC1=CC(=O)OC2=CC(OC3=CC(Cl)=C(Cl)C=C3O)=C(O)C=C12
InChIKey
InChIKey=IGIVGYLFQOIJGE-UHFFFAOYSA-N
Formula
C16H10Cl2O5
Mass
353.15
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
- Subclass Hydroxycoumarins
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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
Diarylethers 1-benzopyrans Phenoxy compounds Dichlorobenzenes M-chlorophenols P-chlorophenols Phenol ethers Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Heteroaromatic compounds Lactones Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydroxycoumarin - Diaryl ether - Benzopyran - 1-benzopyran - Phenoxy compound - 4-halophenol - 3-halophenol - 3-chlorophenol - 1,2-dichlorobenzene - 4-chlorophenol - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Chlorobenzene - Phenol - Pyranone - Aryl chloride - Aryl halide - Benzenoid - Pyran - Monocyclic benzene moiety - Heteroaromatic compound - Lactone - Oxacycle - Organoheterocyclic compound - Ether - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organochloride - Organic oxide - Organohalogen 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