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Substance Name: 5'-O-(Bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy-N-(2-methyl-1-oxopropyl)guanosine 3'-(hydrogen butanedioate)
RN: 74405-46-2
InChIKey: XQFLSGUZSODAOB-OJDZSJEKSA-N

Molecular Formula

  • C39-H41-N5-O10

Molecular Weight

  • 739.7779
 
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Names and Synonyms

Synonym

  • EINECS 277-854-8

Systematic Name

  • 5'-O-(Bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy-N-(2-methyl-1-oxopropyl)guanosine 3'-(hydrogen butanedioate)

Registry Numbers

CAS Registry Number

  • 74405-46-2

System Generated Number

  • 0074405462

Structure Descriptors

InChI

1S/C39H41N5O10/c1-23(2)36(48)42-38-41-35-34(37(49)43-38)40-22-44(35)31-20-29(54-33(47)19-18-32(45)46)30(53-31)21-52-39(24-8-6-5-7-9-24,25-10-14-27(50-3)15-11-25)26-12-16-28(51-4)17-13-26/h5-17,22-23,29-31H,18-21H2,1-4H3,(H,45,46)(H2,41,42,43,48,49)/t29-,30+,31+/m0/s1

InChIKey

XQFLSGUZSODAOB-OJDZSJEKSA-N

Smiles

COc1ccc(cc1)C(OC[C@H]2O[C@H](C[C@@H]2OC(=O)CCC(=O)O)n3cnc4C(=O)NC(=Nc34)NC(=O)C(C)C)(c5ccccc5)c6ccc(OC)cc6