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Substance Name: Arylazido-beta-alanyl-nadp
RN: 73617-93-3
InChIKey: ALKKAUZMSVMOQI-ZTVSOPISSA-N

Molecular Weight

  • 976.593
 
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Names and Synonyms

Name of Substance

  • Arylazido-beta-alanyl-nadp

Synonyms

  • Arylazido-beta-alanyl-nadp(+)
  • Arylazido-beta-alanyl-NADPH
  • N-(3'-O-(3-(N-Azido-2-nitrophenyl)amino)propionyl)nadp

Systematic Name

  • beta-Alanine, N- (4-azido-2-nitrophenyl)-, 2'-ester with adenosine 5'-(trihydrogen diphosphate) 2'-(dihydrogen phosphate) 5'-5'-ester with 3-(aminocarbonyl)-1-beta-D-ribofuranosylpyridinium hydroxide inner salt

Registry Numbers

CAS Registry Number

  • 73617-93-3

System Generated Number

  • 0073617933

Structure Descriptors

InChI

1S/C30H35N12O20P3/c31-26-21-28(36-12-35-26)41(13-37-21)30-25(22(44)18(58-30)10-57-65(54,55)62-63(49,50)51)61-64(52,53)56-11-19-24(23(45)29(59-19)40-7-1-2-14(9-40)27(32)46)60-20(43)5-6-34-16-4-3-15(38-39-33)8-17(16)42(47)48/h1-4,7-9,12-13,18-19,22-25,29-30,34,44H,5-6,10-11H2,(H2,32,46)(H,52,53)(H,54,55)(H2,31,35,36)(H2,49,50,51)/t18-,19-,22-,23-,24-,25-,29-,30-/m1/s1

InChIKey

ALKKAUZMSVMOQI-ZTVSOPISSA-N

Smiles

C([C@@H]1[C@@H](O)[C@H]([C@@H](O1)n1cnc2c(N)ncnc12)O[P@@](=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)[n+]1cccc(c1)C(=O)N)[O-])OC(CCNc1c(cc(cc1)N=[N+]=[N-])[N+](=O)[O-])=O)O[P@@](OP(=O)(O)O)(=O)O