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Substance Name: ATP Gammap-imidazolidate
RN: 81483-81-0
InChIKey: KMJRKPSVWPKZFD-QYVSTXNMSA-N

Note

  • Ca(+)-transporting ATPase inhibitor.

Molecular Formula

  • C13-H18-N7-O12-P3

Molecular Weight

  • 557.2442
 
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Names and Synonyms

Name of Substance

  • ATP Gammap-imidazolidate

Synonyms

  • Adenosine 5'-(trihydrogen diphosphate) gammap-imidazolidate
  • ATP-Gpi

Systematic Name

  • Adenosine 5'-(trihydrogen diphosphate), monoanhydride with 1H-imidazol-1-ylphosphonic acid

Registry Numbers

CAS Registry Number

  • 81483-81-0

System Generated Number

  • 0081483810

Structure Descriptors

InChI

1S/C13H18N7O12P3/c14-11-8-12(17-4-16-11)20(6-18-8)13-10(22)9(21)7(30-13)3-29-34(25,26)32-35(27,28)31-33(23,24)19-2-1-15-5-19/h1-2,4-7,9-10,13,21-22H,3H2,(H,23,24)(H,25,26)(H,27,28)(H2,14,16,17)/t7-,9-,10-,13-/m1/s1

InChIKey

KMJRKPSVWPKZFD-QYVSTXNMSA-N

Smiles

c1cn(cn1)P(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)n3cnc4c3ncnc4N)O)O