Structure Information
Structure

Compound Identification

SMILES

COC1=C2OC=CC2=C(C2=C1OC(=O)C=C2)S(=O)(=O)NCCCNCCCCNCCCNS(=O)(=O)C1=C2C=COC2=C(OC)C2=C1C=CC(=O)O2

InChIKey

InChIKey=HCNVOBSPTPKFGQ-UHFFFAOYSA-N

Formula

C34H38N4O12S2

Mass

758.81

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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

8-methoxypsoralens

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

8-methoxypsoralen - Benzopyran - 1-benzopyran - Benzofuran - Anisole - Phenol ether - Alkyl aryl ether - Pyranone - Pyran - Organosulfonic acid amide - Benzenoid - Aminosulfonyl compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Furan - Lactone - Secondary amine - Secondary aliphatic amine - Ether - Organoheterocyclic compound - Oxacycle - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 8-methoxypsoralens. These are psoralens containing a methoxy group attached at the C8 position of the psoralen group.

External Descriptors

Not available

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