Compound Identification
SMILES
OC(C(O)C(O)=O)C(O)=O.FC1=CC=C(CN(C2CCN(CCC3OCCCO3)CC2)C(=O)CC2=CC3=C(OCC3)C=C2)C=C1
InChIKey
InChIKey=SSQXVJRDGNCXMQ-UHFFFAOYSA-N
Formula
C32H41FN2O10
Mass
632.682
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Coumarans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Coumarans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarans
Alternative Parents
Alkyl aryl ethers Beta hydroxy acids and derivatives Sugar acids and derivatives Short-chain hydroxy acids and derivatives Fluorobenzenes 1,3-dioxanes Alpha hydroxy acids and derivatives Aryl fluorides Dicarboxylic acids and derivatives Fatty acids and conjugates Monosaccharides Piperidines Tertiary carboxylic acid amides Secondary alcohols 1,2-diols Trialkylamines Amino acids and derivatives Carboxylic acids Azacyclic compounds Oxacyclic compounds Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Not available
Substituents
Coumaran - Alkyl aryl ether - Beta-hydroxy acid - Fluorobenzene - Halobenzene - Short-chain hydroxy acid - Sugar acid - Meta-dioxane - Alpha-hydroxy acid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydroxy acid - Monosaccharide - Piperidine - Benzenoid - Fatty acid - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Amino acid or derivatives - Tertiary amine - 1,2-diol - Carboxamide group - Secondary alcohol - Azacycle - Acetal - Oxacycle - Ether - Carboxylic acid - Carboxylic acid derivative - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Amine - Organohalogen compound - Organofluoride - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring.
External Descriptors
Not available