For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

#40;[(2S)-3-(6-AMINO-9H-PURIN-9-YL)-2-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3-YL)-PROPYL]-3,4-BIS-O-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3

Compound with spectra: 2 NMR

#40;[(2S)-3-(6-AMINO-9H-PURIN-9-YL)-2-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3-YL)-PROPYL]-3,4-BIS-O-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3
SpectraBase Compound ID 3Z1g8mXy7Kl
InChI InChI=1S/C44H46N5O15P3/c45-42-39-43(47-28-46-42)49(29-48-39)18-37(62-65(50)56-20-31-12-4-5-13-32(31)21-57-65)26-54-44-41(53-19-30-10-2-1-3-11-30)40(64-67(52)60-24-35-16-8-9-17-36(35)25-61-67)38(27-55-44)63-66(51)58-22-33-14-6-7-15-34(33)23-59-66/h1-17,28-29,37-38,40-41,44H,18-27H2,(H2,45,46,47)/t37-,38-,40-,41+,44-/m1/s1
InChIKey WIBFJEXVMYXXIV-WBYNBMEXSA-N
Mol Weight 977.8 g/mol
Molecular Formula C44H46N5O15P3
Exact Mass 977.220327 g/mol
Enantiomer InChIKey WIBFJEXVMYXXIV-NCMIDVKWSA-N

View Spectrum of #40;[(2S)-3-(6-AMINO-9H-PURIN-9-YL)-2-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3-YL)-PROPYL]-3,4-BIS-O-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3

31P NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3

View Spectrum of #40;[(2S)-3-(6-AMINO-9H-PURIN-9-YL)-2-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3-YL)-PROPYL]-3,4-BIS-O-(3,4-DIHYDRO-3-OXIDO-2,4,3-BENZODIOXAPHOSPHEPIN-3

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
9-.alpha.-[2,3,5-O-Tribenzyl-d-arabinosyl]adenine
(S-P)-[16-O,17-O,18-O]-CAMP-METHYLESTER
ADENOSINE 3',5'-CYCLIC MONOPHOSPHATE ANION
Adenosine 3',5'-cyclic phosphate anion
ADENOSINE-5'-BIS(2,4,6-TRIMETHYLBENZOYL)PHOSPHATE
NXHYZAYCOJGMPO-UHFFFAOYSA-N
3'-Amino-3'-deoxy-adenosine-3',5'-cyclothionophosphate anion
5'-deoxy-5'-methylthioadenosine, 2TMS
3'-O-LEVULINYL-2'-O-(2-METHOXYETHYL)-ADENOSINE
BENZYL-2-ACETAMIDO-4,6-O-BENZYLIDENE-2-DEOXY-ALPHA-D-ALLOPYRANOSIDE-CYCLIC-(S,S)-DIPHENYLETHYLENE-PHOSPHITE
Title Journal or Book Year
d-myo-Inositol-1,4,5-trisphosphate and Adenophostin Mimics: Importance of the Spatial Orientation of a Phosphate Group on the Biological Activity Bioorganic & Medicinal Chemistry 2002
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.