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Substance Name: Adenosine, N-(2-(5-carboxyethyl-1H-indol-3-yl)ethyl)-
ID: AU73572420
InChIKey: ABEVKPGHUSNBBT-UGTJMOTHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H26-N6-O5

Molecular Weight

  • 482.4944
 
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Names and Synonyms

Synonyms

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

Systematic Name

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

Registry Numbers

ID Number

  • NIOSH/AU7357242

System Generated Number

  • AU73572420

Structure Descriptors

InChI

InChI=1S/C23H26N6O6/c30-9-16-19(33)20(34)23(35-16)29-11-28-18-21(26-10-27-22(18)29)24-6-5-13-8-25-15-3-1-12(7-14(13)15)2-4-17(31)32/h1,3,7-8,10-11,16,19-20,23,25,30,33-34H,2,4-6,9H2,(H,31,32)(H,24,26,27)/t16-,19-,20-,23-/m1/s1

InChIKey

ABEVKPGHUSNBBT-UGTJMOTHSA-N

Smiles

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