KANAMYCIN A

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Synonyms
Status
Molecule Category Free-form
UNII EQK9Q303C5

Structure

InChI Key SBUJHOSQTJFQJX-KSACQAOKSA-N
Smiles NC[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@@H](O)[C@H](O)[C@H]1O
InChI
InChI=1S/C18H36N4O11/c19-2-6-10(25)12(27)13(28)18(30-6)33-16-5(21)1-4(20)15(14(16)29)32-17-11(26)8(22)9(24)7(3-23)31-17/h4-18,23-29H,1-3,19-22H2/t4-,5+,6+,7-,8+,9-,10+,11-,12-,13+,14-,15+,16-,17-,18+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H36N4O11
Molecular Weight 484.5
AlogP -7.29
Hydrogen Bond Acceptor 15.0
Hydrogen Bond Donor 11.0
Number of Rotational Bond 6.0
Polar Surface Area 282.61
Molecular species BASE
Aromatic Rings 0.0
Heavy Atoms 33.0

Pharmacology

EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Escherichia coli
300-300 - - - -
Staphylococcus aureus
- 24 - - 61-92

Related Entries

Cross References

Resources Reference
ChEMBL CHEMBL223520
FDA SRS EQK9Q303C5
PubChem 6032
ZINC ZINC000043562055
CONTENTS