Compound Identification
SMILES
NC(=O)C1C(=O)C=C2C=C3C=C4C=CC(NC(=O)COCC5=CC=CC=C5)=C(O)C4=C(O)C3=C(O)C2(O)C1=O
InChIKey
InChIKey=CAEQVMGZPZCVNH-UHFFFAOYSA-N
Formula
C28H22N2O9
Mass
530.489
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Tetracyclines
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Tetracyclines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetracyclines
Alternative Parents
Anthracenecarboxylic acids and derivatives Naphthols and derivatives Benzylethers N-arylamides Cyclohexenones Beta-diketones 1-hydroxy-4-unsubstituted benzenoids Tertiary alcohols Secondary carboxylic acid amides Primary carboxylic acid amides Polyols Dialkyl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Tetracycline - Anthracene carboxylic acid or derivatives - 1-naphthol - Naphthalene - Benzylether - N-arylamide - 1-hydroxy-4-unsubstituted benzenoid - Cyclohexenone - 1,3-diketone - Phenol - Monocyclic benzene moiety - Benzenoid - 1,3-dicarbonyl compound - Tertiary alcohol - Primary carboxylic acid amide - Ketone - Secondary carboxylic acid amide - Cyclic ketone - Carboxamide group - Carboxylic acid derivative - Dialkyl ether - Ether - Polyol - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - 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