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

*Links on SpectraBase are not permalinks.

(1'S,2'R,3'S,4'R,5'S)-4-(6-AMINO-2-METHYLTHIOOXY-9H-PURIN-9-YL)-1-[PHOSPHORYLOXYMETHYL]-BICYCLO-[3.1.0]-HEXANE-2,3-DIOL

Compound with spectra: 1 NMR

(1'S,2'R,3'S,4'R,5'S)-4-(6-AMINO-2-METHYLTHIOOXY-9H-PURIN-9-YL)-1-[PHOSPHORYLOXYMETHYL]-BICYCLO-[3.1.0]-HEXANE-2,3-DIOL
SpectraBase Compound ID 5xU1Ll6KW1p
InChI InChI=1S/C13H18N5O7PS/c1-24-27-12-16-10(14)6-11(17-12)18(4-15-6)7-5-2-13(5,9(20)8(7)19)3-25-26(21,22)23/h4-5,7-9,19-20H,2-3H2,1H3,(H2,14,16,17)(H2,21,22,23)/t5-,7-,8+,9+,13+/m1/s1
InChIKey RRURYKRUBINXQA-XEMBYONJSA-N
Mol Weight 419.35 g/mol
Molecular Formula C13H18N5O7PS
Exact Mass 419.066456 g/mol
Enantiomer InChIKey RRURYKRUBINXQA-GPWDXTBVSA-N

View Spectrum of (1'S,2'R,3'S,4'R,5'S)-4-(6-AMINO-2-METHYLTHIOOXY-9H-PURIN-9-YL)-1-[PHOSPHORYLOXYMETHYL]-BICYCLO-[3.1.0]-HEXANE-2,3-DIOL

31P NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O
(1'S,2'R,3'S,4'R,5'S)-4-(6-AMINO-2-METHYLTHIO-9H-PURIN-9-YL)-1-[PHOSPHORYLOXYMETHYL]-BICYCLO-[3.1.0]-HEXANE-2,3-DIOL
[(1R,2R,3S,4R,5S)-4-(6-amino-2-chloropurin-9-yl)-2,3-dihydroxy-1-bicyclo[3.1.0]hexanyl]methoxy-imidazol-1-ylphosphinic acid
(1'-S,2'-R,3'-S,4'-R,5'-S)-4'-(6-AMINO-2-CHLOROPURIN-9-YL)-2',3'-(DIHYDROXY)-1'-(METHYLPHOSPHONIC_ACID)-BICYCLO-[3.1.0]-HEXANE
(1'-S,2'-R,3'-S,4'-R,5'-S)-4'-(6-AMINO-2-CHLOROPURIN-9-YL)-2',3'-(DIHYDROXY)-1'-(PHOSPHONOETHENYL)-BICYCLO-[3.1.0]-HEXANE
X1(6-AMINO-2-CHLOROPURIN-9-YL)-2',3'-(DIHYDROXY)-1'-(PHOSPHONOMETHYLENE)-BICYCLO-[3.1.0]-HEXANE
(1'-S,2'-R,3'-S,4'-R,5'-S)-4'-(6-AMINO-2-CHLOROPURIN-9-YL)-2',3'-(DIHYDROXY)-1'-[(E)-PHOSPHONOETHENYL]-BICYCLO-[3.1.0]-HEXANE
(1'-S,2'-R,3'-S,4'-R,5'-S)-4'-(6-AMINOPURIN-9-YL)-2',3'-(DIHYDROXY)-1'-(METHYLPHOSPHONIC_ACID)-BICYCLO-[3.1.0]-HEXANE
DIMETHYL-7-HYDROXY-1-METHYL-4-(PHENYLSULFONYL)-1H-INDOLE-2,6-DICARBOXYLATE
2-ONE-8-BETA-METHACRYLOYLOXY-10-BETA-HYDROXY-GUAIA-3,11(13)-DIEN-6-ALPHA,12-OLIDE
3,6-bis[(p-Methoxycarbonyl)phenyl]tetracyclo[5.4.0.0(2,9).0(8,10)]undeca-3,5-dieno[4,5-d]acenaphthylene
Title Journal or Book Year
Adenine Nucleotide Analogues Locked in a Northern Methanocarba Conformation:  Enhanced Stability and Potency as P2Y1 Receptor Agonists Journal of 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.