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Substance Name: 9H-Purin-6-amine, 9-(3-deoxy-5-O-((4-methoxyphenyl)diphenylmethyl)-3-(1-pyrrolidinyl)-beta-D-arabinofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-
RN: 134963-35-2
InChIKey: LNVWSYVFRVXGFD-JKGXBWLBSA-N

Molecular Formula

  • C54-H52-N6-O5

Molecular Weight

  • 865.0418
 
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Names and Synonyms

Synonyms

  • 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine
  • 3'Pyrrol-5',N6(4MeOTrityl)dA

Systematic Name

  • 9H-Purin-6-amine, 9-(3-deoxy-5-O-((4-methoxyphenyl)diphenylmethyl)-3-(1-pyrrolidinyl)-beta-D-arabinofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-

Registry Numbers

CAS Registry Number

  • 134963-35-2

System Generated Number

  • 0134963352

Structure Descriptors

InChI

1S/C54H52N6O5/c1-62-44-29-25-40(26-30-44)53(38-17-7-3-8-18-38,39-19-9-4-10-20-39)58-50-47-51(56-36-55-50)60(37-57-47)52-49(61)48(59-33-15-16-34-59)46(65-52)35-64-54(41-21-11-5-12-22-41,42-23-13-6-14-24-42)43-27-31-45(63-2)32-28-43/h3-14,17-32,36-37,46,48-49,52,61H,15-16,33-35H2,1-2H3,(H,55,56,58)/t46-,48-,49+,52-/m1/s1

InChIKey

LNVWSYVFRVXGFD-JKGXBWLBSA-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)N1CCCC1)O