Compound Identification
SMILES
CC=C(C)C(=O)OC1C(OC(C)=O)C(C)(C)OC2=C1C1=C(C=C2)C(N)CC(=O)O1
InChIKey
InChIKey=SCGWWGKTJDSKMD-UHFFFAOYSA-N
Formula
C21H25NO7
Mass
403.431
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
-
Subclass
Pyranocoumarins
- Level 5 Angular pyranocoumarins
-
Subclass
Pyranocoumarins
-
Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Pyranocoumarins
Intermediate Tree Nodes
Not available
Direct Parent
Angular pyranocoumarins
Alternative Parents
Pyranochromenes 2,2-dimethyl-1-benzopyrans 3,4-dihydrocoumarins Tricarboxylic acids and derivatives Alkyl aryl ethers Aralkylamines Fatty acid esters Benzenoids Enoate esters Amino acids and derivatives Lactones Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Angular pyranocoumarin - Pyranochromene - 2,2-dimethyl-1-benzopyran - 3,4-dihydrocoumarin - 1-benzopyran - Chromane - Benzopyran - Tricarboxylic acid or derivatives - Aralkylamine - Fatty acid ester - Alkyl aryl ether - Benzenoid - Fatty acyl - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Oxacycle - Ether - Organoheterocyclic compound - Organopnictogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary amine - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as angular pyranocoumarins. These are organic compounds containing a pyran (or a hydrogenated derivative) angularly fused to a coumarin moiety.
External Descriptors
Not available