Compound Identification
SMILES
N[C@@H](CCCCNC(=O)OCCC1=CC(=O)OC2=C1C=CC(O)=C2)C(O)=O
InChIKey
InChIKey=DZEZEPSSLANIMZ-AWEZNQCLSA-N
Formula
C18H22N2O7
Mass
378.381
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
-
Subclass
Hydroxycoumarins
- Level 5 7-hydroxycoumarins
-
Subclass
Hydroxycoumarins
-
Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Hydroxycoumarins
Intermediate Tree Nodes
Not available
Direct Parent
7-hydroxycoumarins
Alternative Parents
1-benzopyrans L-alpha-amino acids Medium-chain fatty acids Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Amino fatty acids Heterocyclic fatty acids Hydroxy fatty acids Carbamate esters Heteroaromatic compounds Amino acids Lactones Carboxylic acids Oxacyclic compounds Monocarboxylic acids and derivatives Monoalkylamines Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-hydroxycoumarin - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Benzopyran - 1-benzopyran - Medium-chain fatty acid - 1-hydroxy-2-unsubstituted benzenoid - Hydroxy fatty acid - Phenol - Heterocyclic fatty acid - Amino fatty acid - Pyranone - Fatty acyl - Pyran - Fatty acid - Benzenoid - Carbamic acid ester - Heteroaromatic compound - Lactone - Amino acid - Amino acid or derivatives - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 7-hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the C7 position the coumarin skeleton.
External Descriptors
Not available