Kanamycin B

C18H37N5O10CAS 4696-76-8483.52 g/mol

Open in Covalent MOL file
NH2OOHOOOOHOHNH2HONH2H2NH2NHOHO
AcetalAlcoholEtherPrimary amine

Properties

Molecular formula
C18H37N5O10
Molar mass
483.52 g/mol
Exact mass
483.2540 Da
Melting point
178–182 °C (decomposes)
logP
-7.33Crippen estimate
Polar surface area
288.4 Ų
H-bond donors / acceptors
11 / 15
Rotatable bonds
6
Stereocentres
R, R, R, S, S, S, R, S, S, R, R, S, R, R, Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
4696-76-8
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](N)[C@@H](O)[C@@H]1O
InChIKey
SKKLOUVUUNMCJE-FQSMHNGLSA-N
InChI
InChI=1S/C18H37N5O10/c19-2-6-11(26)12(27)9(23)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)8(22)10(25)7(3-24)31-18/h4-18,24-29H,1-3,19-23H2/t4-,5+,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+/m0/s1

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Names and synonyms

11 names
  • D-Streptamine, O-3-amino-3-deoxy-α-D-glucopyranosyl-(1→6)-O-[2,6-diamino-2,6-dideoxy-α-D-glucopyranosyl-(1→4)]-2-deoxy-
  • O-3-Amino-3-deoxy-α-D-glucopyranosyl-(1→6)-O-[2,6-diamino-2,6-dideoxy-α-D-glucopyranosyl-(1→4)]-2-deoxy-D-streptamine
  • Kanendomycin
  • Aminodeoxykanamycin
  • 2′-Amino-2′-deoxykanamycin
  • Bekanamycin
  • KDM
  • NK 1006
  • Nebramycin V
  • Nebramycin factor 5
  • Beckanamycin

Work with Kanamycin B

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Kanamycin A59-01-891 % similar Tobramycin32986-56-479 % similar Kanamycin sulfate25389-94-076 % similar Neomycin1404-04-273 % similar Ribostamycin sulfate53797-35-670 % similar Tobramycin sulfate49842-07-167 % similar Tobramycin sulfate79645-27-567 % similar Paromomycin sulfate1263-89-465 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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