Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(O)=O.CCOCCC1=CC(C)=C(OCCNC2=C3C=CSC3=NC=N2)C=C1

InChIKey

InChIKey=SSKDBVXMHSKZEX-UHFFFAOYSA-N

Formula

C21H25N3O6S

Mass

447.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Tyrosols and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Tyrosols and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Tyrosol derivative - Thienopyrimidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Toluene - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyrimidine - Imidolactam - Heteroaromatic compound - Thiophene - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as tyrosols and derivatives. These are compounds containing a hydroxyethyl group attached to the C4 carbon of a phenol group.

External Descriptors

Not available

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