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Substance Name: O(6)-Benzylguanine
RN: 19916-73-5
UNII: 01KC87F8FE
InChIKey: KRWMERLEINMZFT-UHFFFAOYSA-N

Note

  • A suicide inhibitor of O(6)-methylguanine-DNA methyltransferase activity.

Classification Codes

  • Antineoplastic Agents
  • Enzyme Inhibitors

Molecular Formula

  • C12-H11-N5-O

Molecular Weight

  • 241.253
 
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Names and Synonyms

Name of Substance

  • O(6)-Benzylguanine

Synonyms

  • 2-Amino-6-(benzyloxy)purine
  • 2-Amino-6-(phenylmethoxy)-9H-purine
  • 6-(Benzyloxy)guanine
  • 6-(Phenylmethoxy)-1H-purin-2-amine
  • 6-O-Benzylguanine
  • CCRIS 9383
  • NSC 637037
  • O(6)-Benzylguanine
  • O(6)-Bgua
  • O6-Benzylguanine
  • Purine, 2-amino-6-(benzyloxy)-
  • UNII-01KC87F8FE

Systematic Name

  • 1H-Purin-2-amine, 6-(phenylmethoxy)-

Registry Numbers

CAS Registry Number

  • 19916-73-5

FDA UNII

  • 01KC87F8FE

System Generated Number

  • 0019916735

Structure Descriptors

InChI

1S/C12H11N5O/c13-12-16-10-9(14-7-15-10)11(17-12)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,13,14,15,16,17)

InChIKey

KRWMERLEINMZFT-UHFFFAOYSA-N

Smiles

c12c(nc(N)nc1nc[nH]2)OCc1ccccc1