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Substance Name: 1-N-((S)-4-Amino-2-hydroxybutyryl)-2''-deoxykanamycin B
RN: 83071-96-9
InChIKey: GXLIAVWTSGUGBV-UHFFFAOYSA-N

Molecular Weight

  • 1199.27
 
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Names and Synonyms

Name of Substance

  • 1-N-((S)-4-Amino-2-hydroxybutyryl)-2''-deoxykanamycin B

Synonym

  • Ahbd-kanamycin B

Systematic Name

  • D-Streptamine, O-3-amino-2,3-dideoxy-alpha-D-arabino-hexopyranosyl-(1-6)-O-(2,6-diamino-2,6-dideoxy-alpha-D-glucopyranosyl-(1-4))-N1-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, (S)-, carbonate (2:1) (salt)

Registry Numbers

CAS Registry Number

  • 83071-96-9

System Generated Number

  • 0083071969

Structure Descriptors

InChI

1S/2C22H44N6O11.CH2O3/c2*23-2-1-10(30)21(35)28-9-3-8(26)19(39-22-14(27)17(33)16(32)11(5-24)37-22)18(34)20(9)38-13-4-7(25)15(31)12(6-29)36-13;2-1(3)4/h2*7-20,22,29-34H,1-6,23-27H2,(H,28,35);(H2,2,3,4)

InChIKey

GXLIAVWTSGUGBV-UHFFFAOYSA-N

Smiles

O[C@@H]1[C@@H]([C@@H](C[C@@H]([C@@H]1O[C@@H]1[C@@H]([C@@H]([C@@H](O)[C@@H](O1)CN)O)N)N)NC([C@@H](CCN)O)=O)O[C@@H]1O[C@@H]([C@@H]([C@@H](C1)N)O)CO.OC(O)=O.O[C@@H]1[C@@H]([C@@H](C[C@@H]([C@@H]1O[C@@H]1[C@@H]([C@@H]([C@@H](O)[C@@H](O1)CN)O)N)N)NC([C@@H](CCN)O)=O)O[C@@H]1O[C@@H]([C@@H]([C@@H](C1)N)O)CO