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Substance Name: SDZ-WAG-994 sesquihydrate
RN: 143480-90-4
UNII: 0LL796AO8Y
InChIKey: PQNUNCWWHZHWNC-XLZUVWGRSA-N

Molecular Formula

  • 2C17-H25-N5-O4.3H2-O

Molecular Weight

  • 780.8754
 
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Names and Synonyms

Name of Substance

  • SDZ-WAG-994 sesquihydrate

Synonyms

  • Adenosine, N-cyclohexyl-2'-O-methyl-, hydrate (2:3)
  • SDZ-WAG-994 sesquihydrate
  • UNII-0LL796AO8Y
  • WAG-994 sesquihydrate

Registry Numbers

CAS Registry Number

  • 143480-90-4

FDA UNII

  • 0LL796AO8Y

System Generated Number

  • 0143480904

Structure Descriptors

InChI

1S/2C17H25N5O4.3H2O/c2*1-25-14-13(24)11(7-23)26-17(14)22-9-20-12-15(18-8-19-16(12)22)21-10-5-3-2-4-6-10;;;/h2*8-11,13-14,17,23-24H,2-7H2,1H3,(H,18,19,21);3*1H2/t2*11-,13-,14-,17-;;;/m11.../s1

InChIKey

PQNUNCWWHZHWNC-XLZUVWGRSA-N

Smiles

CO[C@@H]1[C@@H]([C@H](O[C@H]1n2cnc3c2ncnc3NC4CCCCC4)CO)O.CO[C@@H]1[C@@H]([C@H](O[C@H]1n2cnc3c2ncnc3NC4CCCCC4)CO)O.O.O.O