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Substance Name: 9H-Purin-6-amine, 9-(3-deoxy-5-O-((4-methoxyphenyl)diphenylmethyl)-3-((phenylmethyl)amino)-beta-D-arabinofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-
RN: 134934-60-4
InChIKey: KKPDCQNFIFUXJX-SCDAOGTMSA-N

Molecular Formula

  • C57-H52-N6-O5

Molecular Weight

  • 901.0748
 
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Names and Synonyms

Synonyms

  • 3'-Benzylamino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine
  • 3'BzNH2-5',N6(4MeOTrityl)dA

Systematic Name

  • 9H-Purin-6-amine, 9-(3-deoxy-5-O-((4-methoxyphenyl)diphenylmethyl)-3-((phenylmethyl)amino)-beta-D-arabinofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-

Registry Numbers

CAS Registry Number

  • 134934-60-4

System Generated Number

  • 0134934604

Structure Descriptors

InChI

1S/C57H52N6O5/c1-65-47-32-28-43(29-33-47)56(41-20-10-4-11-21-41,42-22-12-5-13-23-42)62-53-51-54(60-38-59-53)63(39-61-51)55-52(64)50(58-36-40-18-8-3-9-19-40)49(68-55)37-67-57(44-24-14-6-15-25-44,45-26-16-7-17-27-45)46-30-34-48(66-2)35-31-46/h3-35,38-39,49-50,52,55,58,64H,36-37H2,1-2H3,(H,59,60,62)/t49-,50-,52+,55-/m1/s1

InChIKey

KKPDCQNFIFUXJX-SCDAOGTMSA-N

Smiles

COc1ccc(cc1)C(c2ccccc2)(c3ccccc3)Nc4c5c(ncn4)n(cn5)[C@H]6[C@H]([C@@H]([C@H](O6)COC(c7ccccc7)(c8ccccc8)c9ccc(cc9)OC)NCc1ccccc1)O