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(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
Ethyl 6'-[2,2-dimethyl-(4R)-1,3-dioxolan-4-yl]-4-hydroxy-2',2'-dimethyl-(2'R,3R,3a'S,4R,6'R,6a'S)-spiro[3H,4H,5H-furan-2,4'-perhydrofuro[3,4-d][1,3]dioxole]-3-carboxylate
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
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
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