Structure Information
Structure

Compound Identification

SMILES

[Co++].CC(=NC1=CC=CC=C1[SH2+])C1=C([OH2+])C=CC2=C1OC(=O)C=C2C

InChIKey

InChIKey=RACATVNCVJVAAB-UHFFFAOYSA-P

Formula

C18H17CoNO3S

Mass

386.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Hydroxycoumarins

Intermediate Tree Nodes

Not available

Direct Parent

7-hydroxycoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

7-hydroxycoumarin - Benzopyran - 1-benzopyran - 1-hydroxy-2-unsubstituted benzenoid - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Azomethine - Heteroaromatic compound - Secondary ketimine - Ketimine - Lactone - Organic transition metal salt - Oxacycle - Organoheterocyclic compound - Organic cobalt salt - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Imine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the C7 position the coumarin skeleton.

External Descriptors

Not available

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