Structure Information
Structure

Compound Identification

SMILES

C[NH+](C)[C@H]1[C@@H]2C[C@H]3[C@H](C(=O)C4=C(C=CC=C4O)[C@@]3(C)O)C(=O)[C@@]2([O-])C(=O)C(=C(N)[O-])C1=O

InChIKey

InChIKey=RRFNZADOJUFLLE-KCDYHKOWSA-N

Formula

C22H23N2O8

Mass

443.433

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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 - Tetralin - Aryl ketone - Aryl alkyl ketone - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - 1,3-diketone - Benzenoid - 1,3-dicarbonyl compound - Vinylogous acid - Vinylogous amide - Quaternary ammonium salt - Tertiary alcohol - Ketene acetal or derivatives - Ketone - Tertiary aliphatic amine - Cyclic ketone - Amine - Organic nitrogen compound - Organic oxygen compound - Alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic salt - Organic oxide - Alkoxide - Carbonyl group - Organic cation - 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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