Structure Information
Structure

Compound Identification

SMILES

CN(C)C1C2CC3C(C(=O)C4C(=CC=CC4(N)O)C3(C)O)=C(O)C2(O)C(=O)C(C(=O)NCN2CCCC2)=C1O

InChIKey

InChIKey=YKIVCZFHCXNJED-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

Aliphatic heteropolycyclic compounds

Substituents

Tetracycline - Anthracene carboxylic acid or derivatives - Cyclohexenone - N-alkylpyrrolidine - Cyclic alcohol - Pyrrolidine - Vinylogous acid - Tertiary alcohol - Amino acid or derivatives - Carboxamide group - Ketone - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Alkanolamine - Carboxylic acid derivative - Enol - Polyol - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Alcohol - Organic oxide - Organopnictogen compound - Carbonyl group - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Aliphatic 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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