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Substance Name: 5-Azido-2-nitrobenzoyl-8-azido ATP
RN: 129391-97-5
InChIKey: WQKDGRLVQXNEBZ-SDBHATRESA-N

Molecular Weight

  • 738.3113
 
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Names and Synonyms

Name of Substance

  • 5-Azido-2-nitrobenzoyl-8-azido ATP

Synonym

  • Anb-8-N3-ATP

Registry Numbers

CAS Registry Number

  • 129391-97-5

System Generated Number

  • 0129391975

Structure Descriptors

InChI

1S/C17H17N12O16P3/c18-13-10-14(22-5-21-13)28(17(23-10)25-27-20)15-11(30)12(43-16(31)7-3-6(24-26-19)1-2-8(7)29(32)33)9(42-15)4-41-47(37,38)45-48(39,40)44-46(34,35)36/h1-3,5,9,11-12,15,30H,4H2,(H,37,38)(H,39,40)(H2,18,21,22)(H2,34,35,36)/t9-,11-,12-,15-/m1/s1

InChIKey

WQKDGRLVQXNEBZ-SDBHATRESA-N

Smiles

c1cc(c(cc1N=[N+]=[N-])C(=O)O[C@@H]2[C@H](O[C@H]([C@@H]2O)n3c4c(c(ncn4)N)nc3N=[N+]=[N-])COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[N+](=O)[O-]