Compound Identification
SMILES
Cl.CN(C)[C@H]1C2CC3=C(C)C4=C(C(O)=CC=C4)C(O)=C3C(=O)C2(O)C(O)=C(C(N)=O)C1=O
InChIKey
InChIKey=SPFAOPCHYIJPHJ-GAQDACNLSA-N
Formula
C22H23ClN2O7
Mass
462.88
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 Tetralins Aryl alkyl ketones 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Aralkylamines Cyclohexenones Vinylogous acids Tertiary alcohols Trialkylamines Primary carboxylic acid amides Amino acids and derivatives Polyols Enols Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Tetracycline - Anthracene carboxylic acid or derivatives - 1-naphthol - Naphthalene - Tetralin - Aryl alkyl ketone - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Cyclohexenone - Phenol - Aralkylamine - Benzenoid - Tertiary alcohol - Vinylogous acid - Amino acid or derivatives - Carboxamide group - Ketone - Primary carboxylic acid amide - Tertiary amine - Cyclic ketone - Tertiary aliphatic amine - Enol - Carboxylic acid derivative - Polyol - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Hydrochloride - Carbonyl group - Amine - 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