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Substance Name: 3-Deazaneplanocin
RN: 102052-95-9
UNII: 544SH4020S
InChIKey: OMKHWTRUYNAGFG-IEBDPFPHSA-N

Note

  • S-adenosylhomocysteine hydrolase antagonist.

Molecular Formula

  • C12-H14-N4-O3

Molecular Weight

  • 262.2676
 
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Names and Synonyms

Name of Substance

  • 3-Deazaneplanocin

Synonyms

  • 3-Deaza-neplanocin
  • 3-Deazaneplanocin A
  • UNII-544SH4020S

Systematic Name

  • 3-Cyclopentene-1,2-diol, 5-(4-amino-1H-imidazo(4,5-c)pyridiny-1-yl)-3-(hydroxymethyl)-, (1S-(alpha,2alpha,5beta))-

Registry Numbers

CAS Registry Number

  • 102052-95-9

FDA UNII

  • 544SH4020S

System Generated Number

  • 0102052959

Structure Descriptors

InChI

1S/C12H14N4O3/c13-12-9-7(1-2-14-12)16(5-15-9)8-3-6(4-17)10(18)11(8)19/h1-3,5,8,10-11,17-19H,4H2,(H2,13,14)/t8-,10-,11+/m1/s1

InChIKey

OMKHWTRUYNAGFG-IEBDPFPHSA-N

Smiles

Nc1nccc2c1ncn2[C@@H]3C=C(CO)[C@@H](O)[C@H]3O