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Substance Name: Adenosine tetraphosphopyridoxal
RN: 101418-64-8
InChIKey: GQWHVFNISFUGRD-XKLVTHTNSA-N

Molecular Formula

  • C18-H24-N6-O18-P4

Molecular Weight

  • 736.308
 
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Names and Synonyms

Name of Substance

  • Adenosine tetraphosphopyridoxal

Synonyms

  • Adenosine tetraphosphate pyridoxal
  • AP4-PL

Systematic Name

  • Adenosine 5'(pentahydrogen tetraphosphate), mono((4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl) ester

Registry Numbers

CAS Registry Number

  • 101418-64-8

System Generated Number

  • 0101418648

Structure Descriptors

InChI

1S/C18H24N6O18P4/c1-8-13(26)10(3-25)9(2-20-8)4-37-43(29,30)40-45(33,34)42-46(35,36)41-44(31,32)38-5-11-14(27)15(28)18(39-11)24-7-23-12-16(19)21-6-22-17(12)24/h2-3,6-7,11,14-15,18,26-28H,4-5H2,1H3,(H,29,30)(H,31,32)(H,33,34)(H,35,36)(H2,19,21,22)/t11-,14-,15-,18-/m1/s1

InChIKey

GQWHVFNISFUGRD-XKLVTHTNSA-N

Smiles

C(O[P@@](=O)(O)O[P@@](=O)(O[P@@](O)(=O)O[P@@](=O)(OC[C@@H]1[C@H]([C@H]([C@@H](n2cnc3c(ncnc23)N)O1)O)O)O)O)c1c(c(O)c(nc1)C)C=O