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Substance Name: 3-Aminopyridine adenine dinucleotide phosphate
RN: 54758-28-0
InChIKey: BAXCQRTXEORKEF-HISDBWNOSA-N

Molecular Weight

  • 715.396
 
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Names and Synonyms

Name of Substance

  • 3-Aminopyridine adenine dinucleotide phosphate

Systematic Name

  • 5'-(Trihydrogen diphosphate) 2'-(dihydrogen phosphate), 5'-5'-ester with 3-amino-1-beta-D-ribofuranosylpyridinium, hydroxide, inner salt

Registry Numbers

CAS Registry Number

  • 54758-28-0

System Generated Number

  • 0054758280

Structure Descriptors

InChI

1S/C20H28N7O16P3/c21-9-2-1-3-26(4-9)19-15(30)13(28)10(40-19)5-38-45(34,35)42-16-14(29)11(6-39-46(36,37)43-44(31,32)33)41-20(16)27-8-25-12-17(22)23-7-24-18(12)27/h1-4,7-8,10-11,13-16,19-20,28-29H,5-6,21H2,(H,34,35)(H,36,37)(H2,22,23,24)(H2,31,32,33)/t10-,11-,13-,14-,15-,16-,19-,20-/m1/s1

InChIKey

BAXCQRTXEORKEF-HISDBWNOSA-N

Smiles

c1c(N)ccc[n+]1[C@@H]1O[C@H](CO[P@@](=O)(O)O[C@@H]2[C@@H]([C@@H](CO[P@@](OP(=O)(O)O)(=O)O)O[C@H]2n2cnc3c(N)ncnc23)O)[C@H]([C@H]1[O-])O