Compound Identification
SMILES
COC1=CC(=CC(OC)=C1O)C1C2=C(OC3=C1C(=O)C1=CC=CC=C1O3)OC1=CC=CC=C1C2=O
InChIKey
InChIKey=BYLGHYWAFHYSSL-UHFFFAOYSA-N
Formula
C27H18O8
Mass
470.433
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
Diarylethers Chromones Methoxyphenols Dimethoxybenzenes Phenoxy compounds Anisoles Pyranones and derivatives Alkyl aryl ethers Vinylogous esters Heteroaromatic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chromone - Coumarin - Diaryl ether - Benzopyran - Methoxyphenol - 1-benzopyran - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Pyranone - Phenol - Alkyl aryl ether - Pyran - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous ester - Oxacycle - Ether - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available