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Substance Name: Adenosine, 2'-deoxy-, 5'-P''-ester with thiotriphosphoric acid ((HO)2P(O)OP(O)(OH)OP(S)(OH)2), (S)-
RN: 80875-87-2
InChIKey: CCPIKNHZOWQALM-PCMHVZBYSA-N

Molecular Formula

  • C10-H16-N5-O11-P3-S

Molecular Weight

  • 507.248
 
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Names and Synonyms

Synonym

  • (S)-2'-Deoxyadenosine 5'-P''-ester with thiotriphosphoric acid ((HO)2P(O)OP(O)(OH)OP(S)(OH)2)

Systematic Name

  • Adenosine, 2'-deoxy-, 5'-P''-ester with thiotriphosphoric acid ((HO)2P(O)OP(O)(OH)OP(S)(OH)2), (S)-

Registry Numbers

CAS Registry Number

  • 80875-87-2

System Generated Number

  • 0080875872

Structure Descriptors

InChI

1S/C10H16N5O11P3S/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(24-7)2-23-29(22,30)26-28(20,21)25-27(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H,22,30)(H2,11,12,13)(H2,17,18,19)/t5-,6+,7?,29-/m0/s1

InChIKey

CCPIKNHZOWQALM-PCMHVZBYSA-N

Smiles

C1[C@@H]([n@]2cnc3c2ncnc3N)O[C@@H](CO[P@@](=O)(O[P@@](O)(=O)OP(=O)(O)O)S)[C@H]1O