Compound Identification
SMILES
CC1=CC2=C(C(C)=C(C)C(=O)O2)C(OCC(=O)NCCC(=O)N2CCC3(O)CCCCC3C2)=C1
InChIKey
InChIKey=DSJLURPRTPFQLA-UHFFFAOYSA-N
Formula
C26H34N2O6
Mass
470.566
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
Beta amino acids and derivatives 1-benzopyrans N-acylpiperidines Pyranones and derivatives Alkyl aryl ethers Benzenoids Tertiary carboxylic acid amides Tertiary alcohols Heteroaromatic compounds Secondary carboxylic acid amides Cyclic alcohols and derivatives Lactones Oxacyclic compounds Azacyclic compounds Carbonyl compounds Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Coumarin - Benzopyran - 1-benzopyran - N-acyl-piperidine - Alkyl aryl ether - Pyranone - Benzenoid - Piperidine - Pyran - Heteroaromatic compound - Cyclic alcohol - Tertiary carboxylic acid amide - Tertiary alcohol - Carboxamide group - Lactone - Secondary carboxylic acid amide - Oxacycle - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - 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