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Substance Name: BW A522
RN: 112533-64-9
InChIKey: DKJMGIXWGPEEFF-UHFFFAOYSA-N

Note

  • Blocks adenosine A3 receptor-mediated hypotensive responses in rats.

Molecular Formula

  • C23-H22-I-N5-O5

Molecular Weight

  • 575.357
 
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Names and Synonyms

Name of Substance

  • BW A522

Synonyms

  • 3-(3-Iodo-4-aminobenzyl)-8-(4-oxyacetate)-1-propylxanthine
  • BW-A522
  • I-Abopx

Systematic Name

  • Acetic acid, (4-(3-((4-amino-3-iodophenyl)methyl)-2,3,6,7-tetrahydro-2,6-dioxo-1-propyl-1H-purin-8-yl)phenoxy)-

Registry Numbers

CAS Registry Number

  • 112533-64-9

System Generated Number

  • 0112533649

Structure Descriptors

InChI

1S/C23H22IN5O5/c1-2-9-28-22(32)19-21(29(23(28)33)11-13-3-8-17(25)16(24)10-13)27-20(26-19)14-4-6-15(7-5-14)34-12-18(30)31/h3-8,10H,2,9,11-12,25H2,1H3,(H,26,27)(H,30,31)

InChIKey

DKJMGIXWGPEEFF-UHFFFAOYSA-N

Smiles

C(COc1ccc(cc1)c1[nH]c2c(n(c(n(c2n1)Cc1cc(c(cc1)N)I)=O)CCC)=O)(=O)O