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Substance Name: 3'-Guanylic acid, 5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy-N-(2-methyl-1-oxopropyl)-, mono(4-chlorophenyl) ester, compd. with N,N-diethylethanamine (1:1)
RN: 84379-96-4
InChIKey: SMOJHQGUJHAROZ-ROVOMQDHSA-N

Molecular Formula

  • C41-H41-Cl-N5-O10-P.C6-H15-N

Molecular Weight

  • 931.4184
 
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Names and Synonyms

Synonym

  • EINECS 282-752-1

Systematic Name

  • 3'-Guanylic acid, 5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy-N-(2-methyl-1-oxopropyl)-, mono(4-chlorophenyl) ester, compd. with N,N-diethylethanamine (1:1)

Registry Numbers

CAS Registry Number

  • 84379-96-4

System Generated Number

  • 0084379964

Molecular Formulas

Molecular Formula

  • C41-H41-Cl-N5-O10-P.C6-H15-N

Molecular Formula Fragments

  • C41-H41-Cl-N5-O10-P
  • C6-H15-N
  • COMPONENT

Structure Descriptors

InChI

1S/C41H41ClN5O10P.C6H15N/c1-25(2)38(48)45-40-44-37-36(39(49)46-40)43-24-47(37)35-22-33(57-58(50,51)56-32-20-14-29(42)15-21-32)34(55-35)23-54-41(26-8-6-5-7-9-26,27-10-16-30(52-3)17-11-27)28-12-18-31(53-4)19-13-28;1-4-7(5-2)6-3/h5-21,24-25,33-35H,22-23H2,1-4H3,(H,50,51)(H2,44,45,46,48,49);4-6H2,1-3H3/t33-,34+,35+;/m0./s1

InChIKey

SMOJHQGUJHAROZ-ROVOMQDHSA-N

Smiles

CCN(CC)CC.COc1ccc(cc1)C(OC[C@H]2O[C@H](C[C@@H]2OP(=O)(O)Oc3ccc(Cl)cc3)n4cnc5C(=O)NC(=Nc45)NC(=O)C(C)C)(c6ccccc6)c7ccc(OC)cc7