Structure Information
Structure

Compound Identification

SMILES

CN(C)C1C2CC3C(=C(O)C2(O)C(=O)C(C(=O)NCN2CCCC2)C1(N)O)C(=O)C1=C(C=CC=C1O)C3(C)O

InChIKey

InChIKey=WMQNQVGBAOMTPS-UHFFFAOYSA-N

Formula

C27H36N4O8

Mass

544.605

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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 heteropolycyclic compounds

Substituents

Tetracycline - Anthracene carboxylic acid or derivatives - 2-naphthalenecarboxamide - Beta amino acid or derivatives - Tetralin - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - 1,3-dicarbonyl compound - N-alkylpyrrolidine - Benzenoid - Cyclic alcohol - Pyrrolidine - Tertiary alcohol - Vinylogous acid - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Secondary carboxylic acid amide - Hemiaminal - Ketone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Enol - Alkanolamine - Polyol - Organic oxide - Alcohol - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Primary aliphatic amine - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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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