Compound Identification
SMILES
CC1=COC2=CC3=C(C=C12)C(C)=C(CC(=O)N1CCC2(O)CCCCC2C1)C(=O)O3
InChIKey
InChIKey=OBBYMWBLBQQRLE-UHFFFAOYSA-N
Formula
C24H27NO5
Mass
409.482
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 N-acylpiperidines Benzofurans Pyranones and derivatives Benzenoids Tertiary carboxylic acid amides Tertiary alcohols Heteroaromatic compounds Furans Lactones Cyclic alcohols and derivatives Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Psoralen - 1-benzopyran - Benzopyran - N-acyl-piperidine - Benzofuran - Pyranone - Benzenoid - Pyran - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary alcohol - Furan - Cyclic alcohol - Lactone - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - 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