Compound Identification
SMILES
CCCCCCN(CCCCCC)C1=CC2=C(C=C1)C1=C(C(=O)O2)C(=O)C(\C=C\C=C\C2=C3C=CC(C=C3OC(=C2)C(C)(C)C)=[N+](CCCS(O)(=O)=O)CCCS(O)(=O)=O)C(=O)O1
InChIKey
InChIKey=GZFMKPMIHQASJR-KLCVKJMQSA-O
Formula
C47H61N2O12S2
Mass
910.13
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
- Subclass Coumarino-gamma-pyrones
-
Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Coumarino-gamma-pyrones
Intermediate Tree Nodes
Not available
Direct Parent
Coumarino-gamma-pyrones
Alternative Parents
Angular pyranocoumarins 1-benzopyrans Aryl alkyl ketones Dialkylarylamines Pyranones and derivatives 1,3-dicarbonyl compounds Benzenoids Sulfonyls Secondary ketimines Alkanesulfonic acids Organosulfonic acids Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarino-gamma-pyrone - Pyranocoumarin - Angular pyranocoumarin - Benzopyran - 1-benzopyran - Tertiary aliphatic/aromatic amine - Aryl ketone - Aryl alkyl ketone - Dialkylarylamine - Pyranone - Benzenoid - Pyran - 1,3-dicarbonyl compound - Heteroaromatic compound - Secondary ketimine - Organic sulfonic acid or derivatives - Alkanesulfonic acid - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Carboxylic acid ester - Ketone - Lactone - Amino acid or derivatives - Tertiary amine - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarino-gamma-pyrones. These are organic compounds with a structure characterized by the presence of a pyrano[3,2-c]chromene that carries two ketone groups at the 4- and 5-positions.
External Descriptors
Not available