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Substance Name: N-(4-(1-Pyrenyl)butyryl)-O(1)-(4,4'-dimethoxytrityl)-O(2)-((diisopropylamino)(2-cyanoethoxy)phosphino)-3-amino-1,2-propanediol
RN: 143039-35-4
InChIKey: DGTXRMYVMBMYFU-PTBJPPCHSA-N

Note

  • Used to prepare oligonucleotide derivatives.

Molecular Formula

  • C53-H58-N3-O6-P

Molecular Weight

  • 864.03
 
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Names and Synonyms

Name of Substance

  • N-(4-(1-Pyrenyl)butyryl)-O(1)-(4,4'-dimethoxytrityl)-O(2)-((diisopropylamino)(2-cyanoethoxy)phosphino)-3-amino-1,2-propanediol

Synonyms

  • (R*,S*)-(+-)-1-((Bis(4-methoxyphenyl)phenylmethoxy)methyl)-2-((1-oxo-4-(1-pyrenyl)butyl)amino)ethyl 2-cyanoethyl bis(1-methylethyl)phosphoramidoate
  • Pubdub-pap

Systematic Name

  • Phosphoramidous acid, bis(1-methylethyl)-, 1-((bis(4-methoxyphenyl)phenylmethoxy)methyl)-2-((1-oxo-4-(1-pyrenyl)butyl)amino)ethyl 2-cyanoethyl ester, (R*,S*)- (+-)-

Registry Numbers

CAS Registry Number

  • 143039-35-4

System Generated Number

  • 0143039354

Structure Descriptors

InChI

1S/C53H58N3O6P/c1-37(2)56(38(3)4)63(61-34-12-33-54)62-48(35-55-50(57)18-11-13-39-19-20-42-22-21-40-14-10-15-41-23-32-49(39)52(42)51(40)41)36-60-53(43-16-8-7-9-17-43,44-24-28-46(58-5)29-25-44)45-26-30-47(59-6)31-27-45/h7-10,14-17,19-32,37-38,48H,11-13,18,34-36H2,1-6H3,(H,55,57)/t48-,63+/m0/s1

InChIKey

DGTXRMYVMBMYFU-PTBJPPCHSA-N

Smiles

O([P@](O[C@@H](CNC(CCCc1ccc2ccc3cccc4ccc1c2c34)=O)COC(c1ccccc1)(c1ccc(cc1)OC)c1ccc(cc1)OC)N(C(C)C)C(C)C)CCC#N