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Substance Name: Adenylyl dihydrostreptomycin
RN: 95327-19-8
InChIKey: XBRXZEJTZWTSKA-LYYCMFPXSA-N

Molecular Weight

  • 930.815
 
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Names and Synonyms

Name of Substance

  • Adenylyl dihydrostreptomycin

Synonym

  • Dhs-amp

Systematic Name

  • 5'-Adenylic acid, ester with O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1-2)-O-5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1-4)-N,N'-bis(aminoiminomethyl)-D-streptamine

Registry Numbers

CAS Registry Number

  • 95327-19-8

System Generated Number

  • 0095327198

Structure Descriptors

InChI

1S/C21H41N7O12.C10H14N5O7P/c1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35;11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h5-18,26,29-36H,3-4H2,1-2H3,(H4,22,23,27)(H4,24,25,28);2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+;4-,6-,7-,10?/m01/s1

InChIKey

XBRXZEJTZWTSKA-LYYCMFPXSA-N

Smiles

O1[C@@H](O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)NC(=N)N)O)NC(=N)N)[C@@H]([C@@](CO)([C@@H]1C)O)O[C@H]1[C@H]([C@H](O)[C@H]([C@@H](CO)O1)O)NC.P(O)(=O)(OC[C@@H]1[C@H]([C@H]([C@H]([n@]2cnc3c(ncnc23)N)O1)O)O)O