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Substance Name: 9H-Purin-6-amine, 9-(3-deoxy-3-(diethylamino)-5-O-((4-methoxyphenyl)diphenylmethyl)-beta-D-arabinofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-
RN: 134934-66-0
InChIKey: ZRPUJWDENFDBFP-JKGXBWLBSA-N

Molecular Formula

  • C54-H54-N6-O5

Molecular Weight

  • 867.0576
 
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Names and Synonyms

Synonyms

  • 3'-(N,N-Diethylamino)-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine
  • 3'DiEtNH-5',N6(4MeOTrityl)dA

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 134934-66-0

System Generated Number

  • 0134934660

Structure Descriptors

InChI

1S/C54H54N6O5/c1-5-59(6-2)48-46(35-64-54(41-23-15-9-16-24-41,42-25-17-10-18-26-42)43-29-33-45(63-4)34-30-43)65-52(49(48)61)60-37-57-47-50(55-36-56-51(47)60)58-53(38-19-11-7-12-20-38,39-21-13-8-14-22-39)40-27-31-44(62-3)32-28-40/h7-34,36-37,46,48-49,52,61H,5-6,35H2,1-4H3,(H,55,56,58)/t46-,48-,49+,52-/m1/s1

InChIKey

ZRPUJWDENFDBFP-JKGXBWLBSA-N

Smiles

CCN(CC)[C@@H]1[C@H](O[C@H]([C@H]1O)n2cnc3c2ncnc3NC(c4ccccc4)(c5ccccc5)c6ccc(cc6)OC)COC(c7ccccc7)(c8ccccc8)c9ccc(cc9)OC