The Biofilms Structural Database
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KANAMYCIN

Code

KAN

Name

KANAMYCIN A

Molecular Weight

484.5

Isomeric SMILES

NC[[email protected]]1O[[email protected]](O[[email protected]@H]2[[email protected]@H](N)C[[email protected]@H](N)[[email protected]](O[[email protected]]3O[[email protected]](CO)[[email protected]@H](O)[[email protected]](N)[[email protected]]3O)[[email protected]]2O)[[email protected]](O)[[email protected]@H](O)[[email protected]@H]1O

Formula

C18H36N4O11

Identifiers

(2R,3S,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxy-cyclohexyl]oxy-oxane-3,4,5-triol

Formal Charge

0

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

Atom Count

69

InChIKey

SBUJHOSQTJFQJX-NOAMYHISSA-N

PDB codes

3KP5

Type

NON-POLYMER

Chiral Atom Count

15

Chiral Atoms

C1, C10, C11, C13, C14, C15, C16, C17, C2, C3, C4, C5, C7, C8, C9

Bond Count

71

Aromatic Bond Count

0

Leaving Atoms

n/a