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Substance Name: 2',3'-Di-O-nitro-(5'-N-ethylcarboxamido)adenosine
RN: 61014-07-1
InChIKey: CHMXERRSDPKARP-BSFVXNEUSA-N

Molecular Formula

  • C12-H14-N8-O8

Molecular Weight

  • 398.2906
 
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Names and Synonyms

Name of Substance

  • 2',3'-Di-O-nitro-(5'-N-ethylcarboxamido)adenosine

Synonyms

  • 2',3'-Di-O-nitro-(5'-N-ethylcarboxamido)adenosine
  • 2',3'-Di-O-nitroadenosine-5'-(N-ethylcarboxamide)
  • 2',3'-Dinitro-neca
  • B-744-99
  • Dineca

Systematic Name

  • beta-D-Ribofuranuronamide, 1-(6-amino-9H-purin-9-yl)-1-deoxy-N-ethyl-, 2,3-dinitrate

Registry Numbers

CAS Registry Number

  • 61014-07-1

System Generated Number

  • 0061014071

Structure Descriptors

InChI

1S/C12H14N8O8/c1-2-14-11(21)7-6(27-19(22)23)8(28-20(24)25)12(26-7)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12-/m1/s1

InChIKey

CHMXERRSDPKARP-BSFVXNEUSA-N

Smiles

CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O[N+](=O)[O-])O[N+](=O)[O-]