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Substance Name: 9H-Purin-6-amine, 9-(3-(cyclohexylamino)-3-deoxy-5-O-((4-methoxyphenyl)diphenylmethyl)-beta-D-arabinofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-
RN: 134934-64-8
InChIKey: YYHCOBGZEMUDLQ-COZRLZDLSA-N

Molecular Formula

  • C56-H56-N6-O5

Molecular Weight

  • 893.0954
 
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Names and Synonyms

Synonyms

  • 3'-Cyclohexylamino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine
  • 3'CycloHxNH-5',N6(4MeOTrityl)dA

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 134934-64-8

System Generated Number

  • 0134934648

Structure Descriptors

InChI

1S/C56H56N6O5/c1-64-46-32-28-41(29-33-46)55(39-18-8-3-9-19-39,40-20-10-4-11-21-40)61-52-50-53(58-37-57-52)62(38-59-50)54-51(63)49(60-45-26-16-7-17-27-45)48(67-54)36-66-56(42-22-12-5-13-23-42,43-24-14-6-15-25-43)44-30-34-47(65-2)35-31-44/h3-6,8-15,18-25,28-35,37-38,45,48-49,51,54,60,63H,7,16-17,26-27,36H2,1-2H3,(H,57,58,61)/t48-,49-,51+,54-/m1/s1

InChIKey

YYHCOBGZEMUDLQ-COZRLZDLSA-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)NC1CCCCC1)O