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Substance Name: 3'-O-(N-Methylanthraniloyl)adenosine 5'-diphosphate
RN: 85287-55-4
InChIKey: ANMCUTJZONROBG-LSCFUAHRSA-N

Molecular Formula

  • C18-H22-N6-O11-P2

Molecular Weight

  • 560.3508
 
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Names and Synonyms

Name of Substance

  • 3'-O-(N-Methylanthraniloyl)adenosine 5'-diphosphate

Synonyms

  • 3'-O-(N-methylanthraniloyl)-ADP
  • Mant-ADP

Systematic Name

  • Adenosine 5'-(trihydrogen diphosphate), 3'-(2-(methylamino)benzoate)

Registry Numbers

CAS Registry Number

  • 85287-55-4

System Generated Number

  • 0085287554

Structure Descriptors

InChI

1S/C18H22N6O11P2/c1-20-10-5-3-2-4-9(10)18(26)34-14-11(6-32-37(30,31)35-36(27,28)29)33-17(13(14)25)24-8-23-12-15(19)21-7-22-16(12)24/h2-5,7-8,11,13-14,17,20,25H,6H2,1H3,(H,30,31)(H2,19,21,22)(H2,27,28,29)/t11-,13-,14-,17-/m1/s1

InChIKey

ANMCUTJZONROBG-LSCFUAHRSA-N

Smiles

CNc1ccccc1C(=O)O[C@@H]2[C@H](O[C@H]([C@@H]2O)n3cnc4c3ncnc4N)COP(=O)(O)OP(=O)(O)O