Compound Identification
SMILES
CN1[C@H]2CC[C@H]1CC(C2)OC1=CC2=C(OC(=O)C=C2)C=C1
InChIKey
InChIKey=UCGAYZMIPLPGPA-STQMWFEESA-N
Formula
C17H19NO3
Mass
285.343
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 Tropane alkaloids Phenol ethers Pyranones and derivatives Alkyl aryl ethers Piperidines N-alkylpyrrolidines Heteroaromatic compounds Trialkylamines Lactones Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Tropane alkaloid - Phenol ether - Alkyl aryl ether - Pyranone - Piperidine - Benzenoid - N-alkylpyrrolidine - Pyran - Heteroaromatic compound - Pyrrolidine - Lactone - Tertiary aliphatic amine - Tertiary amine - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Amine - 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