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Substance Name: Nicotinamide ribose 5'-O-(S-(3-bromo-2-oxopropyl))thiophosphate
RN: 150035-59-9
InChIKey: QJQJPCXQNNYCCE-HKUMRIAESA-N

Note

  • Affinity label for NMN sites in enzymes.

Molecular Formula

  • C14-H18-Br-N2-O8-P-S

Molecular Weight

  • 485.246
 
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Names and Synonyms

Name of Substance

  • Nicotinamide ribose 5'-O-(S-(3-bromo-2-oxopropyl))thiophosphate

Synonyms

  • 3-(Aminocarbonyl)-1-(5-O-(((3-bromo-2-oxopropyl)thio)hydroxyphosphinyl)-beta-D-ribofuranosyl)pyridinium inner salt
  • Nmns-bop

Systematic Name

  • Pyridinium, 3-(aminocarbonyl)-1-(5-O-(((3-bromo-2-oxopropyl)thio)hydroxyphosphinyl)-beta-D-ribofuranosyl)-, inner salt

Registry Numbers

CAS Registry Number

  • 150035-59-9

System Generated Number

  • 0150035599

Structure Descriptors

InChI

1S/C14H18BrN2O8PS/c15-4-9(18)7-27-26(22,23)24-6-10-11(19)12(20)14(25-10)17-3-1-2-8(5-17)13(16)21/h1-3,5,10-12,14,19-20H,4,6-7H2,(H2-,16,21,22,23)/t10-,11-,12-,14-/m1/s1

InChIKey

QJQJPCXQNNYCCE-HKUMRIAESA-N

Smiles

O1[C@@H]([n+]2cccc(c2)C(=O)N)[C@@H]([C@@H]([C@H]1COP(SCC(=O)CBr)([O-])=O)O)O