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Substance Name: 2-(4-(2-(2-((4-Azidophenyl)methylcarbonylamino)ethylaminocarbonyl)ethyl)phenyl)ethylamino-5'-N-ethylcarboxamidoadenosine
RN: 129932-69-0
InChIKey: YJGWMZNVZGRORZ-CKXMCULTSA-N

Molecular Formula

  • C33-H40-N12-O6

Molecular Weight

  • 700.757
 
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Names and Synonyms

Name of Substance

  • 2-(4-(2-(2-((4-Azidophenyl)methylcarbonylamino)ethylaminocarbonyl)ethyl)phenyl)ethylamino-5'-N-ethylcarboxamidoadenosine

Synonyms

  • 1-(6-Amino-2-((2-(4-(3-((2-(((4-azidophenyl)acetyl)amino)ethyl)amino)-3-oxopropyl)phenyl)ethyl)amino)-9H-purin-9-yl)-1-deoxy-N-ethyl-beta-D-ribofuranuronamide
  • 125I-Azido-papa-apec

Systematic Name

  • beta-D-Ribofuranuronamide, 1-(6-amino-2-((2-(4-(3-((2-(((4-azidophenyl)acetyl)amino)ethyl)amino)-3-oxopropyl)phenyl)ethyl)amino)-9H-purin-9-yl)-1-deoxy-N-ethyl-

Registry Numbers

CAS Registry Number

  • 129932-69-0

System Generated Number

  • 0129932690

Structure Descriptors

InChI

1S/C33H40N12O6/c1-2-36-31(50)28-26(48)27(49)32(51-28)45-18-40-25-29(34)41-33(42-30(25)45)39-14-13-20-5-3-19(4-6-20)9-12-23(46)37-15-16-38-24(47)17-21-7-10-22(11-8-21)43-44-35/h3-8,10-11,18,26-28,32,48-49H,2,9,12-17H2,1H3,(H,36,50)(H,37,46)(H,38,47)(H3,34,39,41,42)/t26-,27+,28-,32+/m0/s1

InChIKey

YJGWMZNVZGRORZ-CKXMCULTSA-N

Smiles

CCNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2nc(nc3N)NCCc4ccc(cc4)CCC(=O)NCCNC(=O)Cc5ccc(cc5)N=[N+]=[N-])O)O