Structure Information
Structure

Compound Identification

SMILES

COC1=C(C\C=C(\C)CCC=C(C)C)C2=C(C=CC(=O)O2)C(O)=C1.CC(C)=CCC\C(C)=C/CC1=C2OC=CC2=C(O)C2=C1OC(=O)C=C2

InChIKey

InChIKey=SFYIQCDMJFVSEY-ZEMFQRGKSA-N

Formula

C41H46O8

Mass

666.811

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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

Not available

Substituents

5-hydroxypsoralen - Terpene lactone - Hydroxycoumarin - Monoterpenoid - Benzopyran - 1-benzopyran - Aromatic monoterpenoid - Benzofuran - Anisole - Alkyl aryl ether - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Pyran - Furan - Heteroaromatic compound - Lactone - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic oxide - Organooxygen compound - Hydrocarbon derivative - 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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