Compound Identification
SMILES
CC1=CC(C(=O)COC2=CC3=C(C=C2)C(C)=CC(=O)O3)=C(C)N1CC1CCCO1
InChIKey
InChIKey=INPBOVQYYFBMKO-UHFFFAOYSA-N
Formula
C23H25NO5
Mass
395.455
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
1-benzopyrans Aryl alkyl ketones Pyranones and derivatives Alkyl aryl ethers Substituted pyrroles Benzenoids Vinylogous amides Oxolanes Heteroaromatic compounds Lactones Oxacyclic compounds Azacyclic compounds Dialkyl ethers Aldehydes Organonitrogen compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Pyranone - Pyran - Substituted pyrrole - Benzenoid - Oxolane - Heteroaromatic compound - Pyrrole - Vinylogous amide - Ketone - Lactone - Oxacycle - Ether - Dialkyl ether - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aldehyde - Organopnictogen compound - 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