gentamicin

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Ligands
gentamicin

Ligand id: 2427

Name: gentamicin

Structure and Physico-chemical Properties

2D Structure

Calculated Physico-chemical Properties
Hydrogen bond acceptors	12
Hydrogen bond donors	8
Rotatable bonds	7
Topological polar surface area	199.73
Molecular weight	477.32
XLogP	-2.88
No. Lipinski's rules broken	2

Molecular properties generated using the CDK

Classification
Compound class	Synthetic organic
Approved drug?	Yes (source: FDA (1970))

IUPAC Name
2-[4,6-diamino-3-[3-amino-6-(1-methylaminoethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-methylaminooxane-3,5-diol

IUPAC Name

2-[4,6-diamino-3-[3-amino-6-(1-methylaminoethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-methylaminooxane-3,5-diol

International Nonproprietary Names
INN number	INN
1617	gentamicin

Synonyms
gentamicin sulfate

Synonyms

gentamicin sulfate

Database Links
ChEMBL Ligand	CHEMBL329592
DrugBank Ligand	DB00798
PharmGKB Drug	PA449753
PubChem CID	3467
Search Google for chemical match using the InChIKey	CEAZRRDELHUEMR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone	CEAZRRDELHUEMR
Search PubMed clinical trials	gentamicin
Search PubMed titles	gentamicin
Search PubMed titles/abstracts	gentamicin
Wikipedia	Gentamicin

Comments
The approved drug gentamicin is a complex of three closely-related aminoglycoside sulfates: C₁, C1_a and C₂. The structure shown here is representative of the general structure of the compounds. For more information on the structure of the individual components of gentamicin, please see the relevant entries on ChEBI: (CHEBI:27412, CHEBI:27784, CHEBI:28292).

Comments

The approved drug gentamicin is a complex of three closely-related aminoglycoside sulfates: C₁, C1_a and C₂. The structure shown here is representative of the general structure of the compounds. For more information on the structure of the individual components of gentamicin, please see the relevant entries on ChEBI: (CHEBI:27412, CHEBI:27784, CHEBI:28292).