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Substance Name: 5'-Adenylic acid, N,N''-methylenebis-
RN: 36396-32-4
InChIKey: PTGQMINRMBRBAG-NAGRZYTCSA-N

Molecular Formula

  • C21-H28-N10-O14-P2

Molecular Weight

  • 706.456
 
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Names and Synonyms

Synonym

  • N,N''-Methylenebis-5'-adenylic acid

Systematic Name

  • 5'-Adenylic acid, N,N''-methylenebis-

Registry Numbers

CAS Registry Number

  • 36396-32-4

System Generated Number

  • 0036396324

Structure Descriptors

InChI

1S/C21H28N10O14P2/c32-12-8(1-42-46(36,37)38)44-20(14(12)34)30-6-28-10-16(24-4-26-18(10)30)22-3-23-17-11-19(27-5-25-17)31(7-29-11)21-15(35)13(33)9(45-21)2-43-47(39,40)41/h4-9,12-15,20-21,32-35H,1-3H2,(H,22,24,26)(H,23,25,27)(H2,36,37,38)(H2,39,40,41)/t8-,9-,12-,13-,14-,15-,20-,21-/m1/s1

InChIKey

PTGQMINRMBRBAG-NAGRZYTCSA-N

Smiles

O[C@@H]1[C@@H]([C@H](O[C@H]1n1cnc2c1ncnc2NCNc1ncnc2n(cnc12)[C@H]1[C@@H]([C@@H]([C@H](O1)COP(=O)(O)O)O)O)COP(=O)(O)O)O