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Substance Name: 8-Thiocyano-adenosine triphosphate
RN: 139041-17-1
InChIKey: FTOLYLJDISCXPB-KQYNXXCUSA-N

Note

  • A sulfhydryl-reactive analog of ATP; capable of inactivating Na,K-ATPase, hexokinase, and pyruvate kinase.

Molecular Formula

  • C11-H15-N6-O13-P3-S

Molecular Weight

  • 564.256
 
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Names and Synonyms

Name of Substance

  • 8-Thiocyano-adenosine triphosphate

Synonym

  • 8-Thiocyano-ATP

Systematic Name

  • Adenosine 5'-(tetrahydrogen triphosphate), 8-thiocyanato-

Registry Numbers

CAS Registry Number

  • 139041-17-1

System Generated Number

  • 0139041171

Structure Descriptors

InChI

1S/C11H15N6O13P3S/c12-2-34-11-16-5-8(13)14-3-15-9(5)17(11)10-7(19)6(18)4(28-10)1-27-32(23,24)30-33(25,26)29-31(20,21)22/h3-4,6-7,10,18-19H,1H2,(H,23,24)(H,25,26)(H2,13,14,15)(H2,20,21,22)/t4-,6-,7-,10-/m1/s1

InChIKey

FTOLYLJDISCXPB-KQYNXXCUSA-N

Smiles

C([C@@H]1[C@@H](O)[C@@H](O)[C@@H](O1)n1c(nc2c(N)ncnc12)SC#N)O[P@@](O[P@@](OP(=O)(O)O)(=O)O)(=O)O