Compound Identification
SMILES
OC(=O)C1=CC2=CC3=C(C=C2OC1=O)N1CCOCCOCCN(CCOCCOCC1)C1=C(OCCO3)C=C2C=C(C(O)=O)C(=O)OC2=C1
InChIKey
InChIKey=LFSJBWHNFNXXRD-UHFFFAOYSA-N
Formula
C34H36N2O14
Mass
696.662
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 Dialkylarylamines Pyranones and derivatives Alkyl aryl ethers Benzenoids Heteroaromatic compounds Lactones Amino acids Oxacyclic compounds Dialkyl ethers Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - Benzopyran - 1-benzopyran - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - Pyranone - Pyran - Benzenoid - Heteroaromatic compound - Amino acid or derivatives - Lactone - Tertiary amine - Amino acid - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Organic oxide - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen 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