Structure Information
Structure

Compound Identification

SMILES

OS(O)(=O)=O.CN(C)[C@H]1C2CC3Cc4c(I)cc(NC=O)c(O)c4C(O)=C3C(=O)[C@]2(O)C(O)=C(C(N)=O)C1=O

InChIKey

InChIKey=FIHWREGQODLFPI-HETMQKTDSA-N

Formula

C22H24IN3O12S

Mass

681.41

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Tetracyclines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Tetracyclines

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Tetracycline - Anthracene carboxylic acid or derivatives - 1-naphthol - Naphthalene - N-arylamide - 4-iodophenol - Cyclohexenone - Aralkylamine - Sulfuric acid - Aryl halide - Aryl iodide - Benzenoid - Cyclic alcohol - Vinylogous acid - Organic sulfuric acid or derivatives - Tertiary alcohol - Amino acid or derivatives - Carboxamide group - Ketone - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Primary carboxylic acid amide - Enol - Carboxylic acid derivative - Polyol - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Amine - Organic oxygen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Carbonyl group - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as tetracyclines. These are polyketides having an octahydrotetracene-2-carboxamide skeleton, substituted with many hydroxy and other groups.

External Descriptors

Not available

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