Compound Identification
SMILES
COC1=CC(OC)=C(NC(=O)OC2=CC3=C(C=C2)C(C)=CC(=O)O3)C=C1
InChIKey
InChIKey=UMFISGXXMWLFEH-UHFFFAOYSA-N
Formula
C19H17NO6
Mass
355.346
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
Phenylcarbamic acid esters Dimethoxybenzenes 1-benzopyrans Methoxyanilines Phenoxy compounds Anisoles Pyranones and derivatives Alkyl aryl ethers Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Lactones Oxacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylcarbamic acid ester - Coumarin - M-dimethoxybenzene - Dimethoxybenzene - 1-benzopyran - Benzopyran - Methoxyaniline - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Pyranone - Alkyl aryl ether - Benzenoid - Pyran - Monocyclic benzene moiety - Heteroaromatic compound - Carbamic acid ester - Carbonic acid derivative - Lactone - Oxacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - 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