Structure Information
Structure

Compound Identification

SMILES

C\C(CCC(O)C(C)(C)O)=C/COC1=CC(=O)OC2=C1C=C1C=COC1=C2

InChIKey

InChIKey=QBXLTTSHNDZQPD-AWNIVKPZSA-N

Formula

C21H24O6

Mass

372.417

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Furanocoumarins

Intermediate Tree Nodes

Linear furanocoumarins

Direct Parent

Psoralens

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Psoralen - Benzopyran - 1-benzopyran - Benzofuran - Fatty alcohol - Alkyl aryl ether - Pyranone - Pyran - Fatty acyl - Benzenoid - Tertiary alcohol - Heteroaromatic compound - Furan - Vinylogous ester - Secondary alcohol - Lactone - 1,2-diol - Oxacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Organooxygen 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

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