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Substance Name: Adenosine, N-(2-(5-chloro-1H-indol-3-yl)ethyl)-
ID: AU73575670
InChIKey: CHRYLSRQMQTLQJ-WVSUBDOOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-Cl-N6-O4

Molecular Weight

  • 444.8769
 
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Names and Synonyms

Synonyms

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

Systematic Name

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

Registry Numbers

ID Number

  • NIOSH/AU7357567

System Generated Number

  • AU73575670

Structure Descriptors

InChI

1S/C20H21ClN6O4/c21-11-1-2-13-12(5-11)10(6-23-13)3-4-22-18-15-19(25-8-24-18)27(9-26-15)20-17(30)16(29)14(7-28)31-20/h1-2,5-6,8-9,14,16-17,20,23,28-30H,3-4,7H2,(H,22,24,25)/t14-,16-,17-,20-/m1/s1

InChIKey

CHRYLSRQMQTLQJ-WVSUBDOOSA-N

Smiles

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