Compound Identification
SMILES
ClCCN(CCCl)P(Cl)(=O)OC1=C2OC(=O)C=CC2=CC2=C1OC=C2
InChIKey
InChIKey=DRDKAUSJBREKBZ-UHFFFAOYSA-N
Formula
C15H13Cl3NO5P
Mass
424.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
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
-
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
1-benzopyrans Benzofurans Nitrogen mustard compounds Pyranones and derivatives Phosphate esters Benzenoids Organic phosphoramides Furans Heteroaromatic compounds Lactones Oxacyclic compounds Hydrocarbon derivatives Alkyl chlorides Organochlorides Organooxygen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Psoralen - Benzopyran - 1-benzopyran - Benzofuran - Nitrogen mustard - Pyranone - Organic phosphoric acid derivative - Phosphoric acid ester - Pyran - Benzenoid - Organic phosphoric acid amide - Heteroaromatic compound - Furan - Lactone - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Alkyl halide - Organooxygen compound - Organonitrogen compound - Organochloride - Alkyl chloride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - 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