Compound Identification
SMILES
CC1=C(NC(=O)CN2CCCCC2)C2=C(O1)C=CC1=C2OC(=O)C=C1C
InChIKey
InChIKey=NIVBBFJSSJJTOT-UHFFFAOYSA-N
Formula
C20H22N2O4
Mass
354.406
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
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Subclass
Furanocoumarins
- Level 5 Angular furanocoumarins
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Subclass
Furanocoumarins
-
Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Furanocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Angular furanocoumarins
Alternative Parents
Alpha amino acid amides 1-benzopyrans Benzofurans N-arylamides Pyranones and derivatives Piperidines Benzenoids Furans Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Lactones Oxacyclic compounds Azacyclic compounds Carbonyl compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular furanocoumarin - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzopyran - 1-benzopyran - Benzofuran - N-arylamide - Pyranone - Piperidine - Pyran - Benzenoid - Heteroaromatic compound - Furan - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Lactone - Tertiary aliphatic amine - Amino acid or derivatives - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as angular furanocoumarins. These are furanocoumarins, with a structure characterized by a furan ring angularly fused to a coumarin.
External Descriptors
Not available