Structure Information
Structure

Compound Identification

SMILES

CC(C)=CCCC(C)(C=C)C1=C2OC=CC2=C(O)C2=C1OC(=O)C=C2

InChIKey

InChIKey=BXADHWAYPKVGGS-UHFFFAOYSA-N

Formula

C21H22O4

Mass

338.403

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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 - Psoralens

Direct Parent

5-hydroxypsoralens

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5-hydroxypsoralen - Terpene lactone - Aromatic monoterpenoid - Benzopyran - Monoterpenoid - 1-benzopyran - Benzofuran - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Furan - Lactone - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 5-hydroxypsoralens. These are psoralens containing a hydroxyl group attached at the C5 position of the psoralen group.

External Descriptors

Not available

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