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Substance Name: ATP gamma-(N-(2-Chloroethyl)-N-methyl)amide
RN: 90906-29-9
InChIKey: AKGHJVKNYSFKIC-QYVSTXNMSA-N

Molecular Weight

  • 582.722
 
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Names and Synonyms

Name of Substance

  • ATP gamma-(N-(2-Chloroethyl)-N-methyl)amide

Synonyms

  • Adenosine triphosphate gamma-(N-(2-chloroethyl)-N-methyl)amide
  • Cma-ATP

Systematic Name

  • Adenosine 5'-(trihydrogen diphosphate), dichlorobis(2-nitro-1H-imidazole-N3)-, (SP-4-1)-

Registry Numbers

CAS Registry Number

  • 90906-29-9

System Generated Number

  • 0090906299

Structure Descriptors

InChI

1S/C13H22ClN6O12P3/c1-19(3-2-14)33(23,24)31-35(27,28)32-34(25,26)29-4-7-9(21)10(22)13(30-7)20-6-18-8-11(15)16-5-17-12(8)20/h5-7,9-10,13,21-22H,2-4H2,1H3,(H,23,24)(H,25,26)(H,27,28)(H2,15,16,17)/t7-,9-,10-,13-/m1/s1

InChIKey

AKGHJVKNYSFKIC-QYVSTXNMSA-N

Smiles

O=[P@@](O[P@@](=O)(O)O[P@@](=O)(O)OC[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O1)n1cnc2c(N)ncnc12)(O)[N@@](C)CCCl