Compound Identification
SMILES
CC1=CC2=C(OC(C3=CC=CC=C3[N+]([O-])=O)C2(O)C(F)(F)F)C=C1
InChIKey
InChIKey=BKRBRJQPVIQWQE-UHFFFAOYSA-N
Formula
C16H12F3NO4
Mass
339.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
2-arylbenzofuran flavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
2-arylbenzofuran flavonoids
Alternative Parents
Lignans, neolignans and related compounds Coumarans Nitrobenzenes Nitroaromatic compounds Alkyl aryl ethers Tertiary alcohols Fluorohydrins Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organic oxides Organic salts Hydrocarbon derivatives Organic zwitterions Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - Neolignan skeleton - Coumaran - Nitrobenzene - Nitroaromatic compound - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Fluorohydrin - Halohydrin - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Allyl-type 1,3-dipolar organic compound - Ether - Organic oxoazanium - Organic salt - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organic nitrogen compound - Alcohol - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Alkyl halide - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.
External Descriptors
Not available