Structure Information
Structure

Compound Identification

SMILES

CN(C)[C@@H]1C(=O)[C@@H](C(N)=O)C(=O)[C@@]2(C#N)C(=O)[C@H]3C(=O)c4c(O)ccc(-c5cccc(c5)C(N)=O)c4C[C@@]3(N)C[C@@]12N

InChIKey

InChIKey=BOJFZFVRNIVOSH-USOPMLABSA-N

Formula

C29H28N6O7

Mass

572.578

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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 - 2-naphthalenecarboxamide - Tetralin - Benzamide - Benzoic acid or derivatives - Aryl alkyl ketone - Aryl ketone - Benzoyl - 1,3-diketone - Aralkylamine - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Vinylogous acid - Amino acid or derivatives - Carboxamide group - Ketone - Cyclic ketone - Tertiary aliphatic amine - Primary carboxylic acid amide - Tertiary amine - Carbonitrile - Carboxylic acid derivative - Nitrile - Primary aliphatic amine - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Primary amine - Cyanide - Organic oxide - 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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