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Substance Name: Pyridoxal(5')diphospho(1)-glucose
RN: 80503-46-4
InChIKey: DBXOOCKABATHSN-ZFUCKRBASA-L

Molecular Formula

  • C14-H21-N-O14-P2.2Na

Molecular Weight

  • 533.2251
 
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Names and Synonyms

Name of Substance

  • Pyridoxal(5')diphospho(1)-glucose

Synonym

  • 5-Pdpg

Systematic Name

  • alpha-D-Glucopyranose, 1-(P'-((4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl) dihydrogen diphosphate), disodium salt

Registry Numbers

CAS Registry Number

  • 80503-46-4

System Generated Number

  • 0080503464

Molecular Formulas

Molecular Formula

  • C14-H21-N-O14-P2.2Na

Molecular Formula Fragments

  • C14-H21-N-O14-P2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C14H21NO14P2.2Na/c1-6-10(18)8(3-16)7(2-15-6)5-26-30(22,23)29-31(24,25)28-14-13(21)12(20)11(19)9(4-17)27-14;;/h2-3,9,11-14,17-21H,4-5H2,1H3,(H,22,23)(H,24,25);;/q;2*+1/p-2/t9-,11-,12+,13-,14-;;/m1../s1

InChIKey

DBXOOCKABATHSN-ZFUCKRBASA-L

Smiles

Cc1c(c(c(cn1)COP(=O)([O-])OP(=O)([O-])O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C=O)O.[Na+].[Na+]