Compound Identification
SMILES
OC1=CC2=C(C=C1)C(COC1=C(C=CC(F)=C1)[N+]([O-])=O)=CC(=O)O2
InChIKey
InChIKey=PWLLHTGNAHPNDX-UHFFFAOYSA-N
Formula
C16H10FNO6
Mass
331.255
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
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Subclass
Hydroxycoumarins
- Level 5 7-hydroxycoumarins
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Subclass
Hydroxycoumarins
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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
Nitrophenyl ethers 1-benzopyrans Phenoxy compounds Phenol ethers Nitroaromatic compounds Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Fluorobenzenes Aryl fluorides Heteroaromatic compounds Lactones Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organofluorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7-hydroxycoumarin - Nitrophenyl ether - 1-benzopyran - Benzopyran - Nitrobenzene - Phenoxy compound - Phenol ether - Nitroaromatic compound - Pyranone - Fluorobenzene - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Monocyclic benzene moiety - Pyran - Benzenoid - Aryl halide - Aryl fluoride - Heteroaromatic compound - Organic nitro compound - Lactone - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Organic oxoazanium - Ether - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic salt - Organohalogen compound - Organic nitrogen compound - Organofluoride - Hydrocarbon derivative - Organic oxide - Organic cation - 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