Compound Identification
SMILES
CC1=C2OC(=O)C(=C(C)C2=CC2=C1OC(C[N+]1=CC=CC3=CC=CC=C13)C2)[N+]([O-])=O
InChIKey
InChIKey=OHNIEQYHLOAFNM-UHFFFAOYSA-N
Formula
C23H19N2O5
Mass
403.413
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Coumarins and derivatives
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Subclass
Furanocoumarins
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Level 5
Linear furanocoumarins
- Level 6 Psoralens
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Level 5
Linear furanocoumarins
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Subclass
Furanocoumarins
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Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Furanocoumarins
Intermediate Tree Nodes
Linear furanocoumarins
Direct Parent
Psoralens
Alternative Parents
Quinolines and derivatives 1-benzopyrans Coumarans Nitroaromatic compounds Pyranones and derivatives Alkyl aryl ethers Pyridinium derivatives Benzenoids Heteroaromatic compounds Lactones Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Psoralen - Benzopyran - 1-benzopyran - Quinoline - Coumaran - Nitroaromatic compound - Alkyl aryl ether - Pyranone - Pyran - Pyridine - Benzenoid - Pyridinium - Heteroaromatic compound - Lactone - C-nitro compound - Organic nitro compound - Ether - Organic oxoazanium - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as psoralens. These are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one.
External Descriptors
Not available