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Substance Name: N(1)-Pentadecanoyl-N(3'')-trifluoracetylkanamycin A
RN: 92396-07-1
InChIKey: QKAYGRBHBMRHEC-UHFFFAOYSA-N

Molecular Formula

  • C35-H63-F3-N4-O13

Molecular Weight

  • 804.892
 
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Names and Synonyms

Name of Substance

  • N(1)-Pentadecanoyl-N(3'')-trifluoracetylkanamycin A

Synonym

  • PTKA

Registry Numbers

CAS Registry Number

  • 92396-07-1

System Generated Number

  • 0092396071

Structure Descriptors

InChI

1S/C35H63F3N4O13/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22(44)41-19-15-18(40)30(54-33-28(49)27(48)25(46)20(16-39)52-33)29(50)31(19)55-32-26(47)23(24(45)21(17-43)53-32)42-34(51)35(36,37)38/h18-21,23-33,43,45-50H,2-17,39-40H2,1H3,(H,41,44)(H,42,51)

InChIKey

QKAYGRBHBMRHEC-UHFFFAOYSA-N

Smiles

C(CCCCCCCCCCCCC)C(N[C@@H]1C[C@@H](N)[C@@H]([C@@H]([C@@H]1O[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)NC(C(F)(F)F)=O)O)O)O[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CN)O)O)O)=O