Compound Identification
SMILES
CC1=C(C)C2=C(O1)C(C)=C1OC(=O)C(CCC(=O)NCCCN3CCCC3=O)=C(C)C1=C2
InChIKey
InChIKey=QUMQGUKQKPMFHH-UHFFFAOYSA-N
Formula
C25H30N2O5
Mass
438.524
Taxonomic Classification
Taxonomy Tree
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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
1-benzopyrans Benzofurans Pyranones and derivatives Pyrrolidine-2-ones Benzenoids Fatty amides N-alkylpyrrolidines Tertiary carboxylic acid amides Furans Heteroaromatic compounds Secondary carboxylic acid amides Lactones Lactams Azacyclic compounds Oxacyclic compounds Organic oxides Organonitrogen compounds Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Psoralen - Benzopyran - 1-benzopyran - Benzofuran - Pyranone - Fatty amide - Pyran - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Fatty acyl - Heteroaromatic compound - Tertiary carboxylic acid amide - Furan - Pyrrolidine - Secondary carboxylic acid amide - Carboxamide group - Lactam - Lactone - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organopnictogen 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