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
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 Cyclohexenones N-alkylpyrrolidines Vinylogous acids Tertiary alcohols Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Cyclic alcohols and derivatives Alkanolamines Polyols Azacyclic compounds Enols Organic oxides Monoalkylamines Organopnictogen compounds Hydrocarbon derivatives
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