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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Coumarins and derivatives
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Subclass
Hydroxycoumarins
- Level 5 7-hydroxycoumarins
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Subclass
Hydroxycoumarins
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Class
Coumarins and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Hydroxycoumarins
Intermediate Tree Nodes
Not available
Direct Parent
7-hydroxycoumarins
Alternative Parents
1-benzopyrans Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Secondary ketimines Azomethines Heteroaromatic compounds Lactones Oxacyclic compounds Organosulfur compounds Hydrocarbon derivatives Organic cobalt salts Organic oxides Organooxygen compounds Organopnictogen compounds Organic cations
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