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Substance Name: Adenosine, N-(2-(5-nitro-1H-indol-3-yl)ethyl)-
ID: AU74105320
InChIKey: MQCARFWCFWJSFW-WVSUBDOOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-N7-O6

Molecular Weight

  • 455.4289
 
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Names and Synonyms

Synonyms

  • N(sup 6)-(beta-(5-Nitroindolyl-3)-ethyl)adenosine
  • N-(2-(5-Nitro-1H-indol-3-yl)ethyl)adenosine

Systematic Name

  • Adenosine, N-(2-(5-nitro-1H-indol-3-yl)ethyl)-

Registry Numbers

ID Number

  • NIOSH/AU7410532

System Generated Number

  • AU74105320

Structure Descriptors

InChI

1S/C20H21N7O6/c28-7-14-16(29)17(30)20(33-14)26-9-25-15-18(23-8-24-19(15)26)21-4-3-10-6-22-13-2-1-11(27(31)32)5-12(10)13/h1-2,5-6,8-9,14,16-17,20,22,28-30H,3-4,7H2,(H,21,23,24)/t14-,16-,17-,20-/m1/s1

InChIKey

MQCARFWCFWJSFW-WVSUBDOOSA-N

Smiles

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(NCCc4c[nH]c5ccc(cc45)[N+](=O)[O-])ncnc23