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N-1-[(1R,2S,3R,4R)-2,3-(ISOPROPYLIDENEDIOXY)-4-(HYDROXYMETHYL)-CYCLOPENTYL]-5'-O-[BIS-(PHENYLTHIO)-PHOSPHORYL]-2',3'-O-ISOPROPYLIDENE-ADENOSINE

View entire compound with spectra: 1 NMR

N-1-[(1R,2S,3R,4R)-2,3-(ISOPROPYLIDENEDIOXY)-4-(HYDROXYMETHYL)-CYCLOPENTYL]-5'-O-[BIS-(PHENYLTHIO)-PHOSPHORYL]-2',3'-O-ISOPROPYLIDENE-ADENOSINE
SpectraBase Compound ID 4TdLRZWrngz
InChI InChI=1S/C34H40N5O8PS2/c1-33(2)44-26-20(16-40)15-23(27(26)45-33)38-19-37-31-25(30(38)35)36-18-39(31)32-29-28(46-34(3,4)47-29)24(43-32)17-42-48(41,49-21-11-7-5-8-12-21)50-22-13-9-6-10-14-22/h5-14,18-20,23-24,26-29,32,35,40H,15-17H2,1-4H3/t20-,23-,24-,26-,27+,28-,29-,32-/m1/s1
InChIKey FFGHASYUBSGPOR-HOOWLYSUSA-N
Mol Weight 741.8 g/mol
Molecular Formula C34H40N5O8PS2
Exact Mass 741.205593 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5KdXKvbET8m
Name N-1-[(1R,2S,3R,4R)-2,3-(ISOPROPYLIDENEDIOXY)-4-(HYDROXYMETHYL)-CYCLOPENTYL]-5'-O-[BIS-(PHENYLTHIO)-PHOSPHORYL]-2',3'-O-ISOPROPYLIDENE-ADENOSINE
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H40N5O8PS2
InChI InChI=1S/C34H40N5O8PS2/c1-33(2)44-26-20(16-40)15-23(27(26)45-33)38-19-37-31-25(30(38)35)36-18-39(31)32-29-28(46-34(3,4)47-29)24(43-32)17-42-48(41,49-21-11-7-5-8-12-21)50-22-13-9-6-10-14-22/h5-14,18-20,23-24,26-29,32,35,40H,15-17H2,1-4H3/t20-,23-,24-,26-,27+,28-,29-,32-/m1/s1
InChIKey FFGHASYUBSGPOR-HOOWLYSUSA-N
Literature Reference Author S.SHUTO,M.FUKUOKA,A.MANIKOWSKY,Y.UENO,T.NAKANO,R.KURODA,H.KU RODA,A.MATSUDA
Literature Reference Citation J.AM.CHEM.SOC.,123,8750(2001)
Literature Reference DOI 10.1021/ja010756d
Solvent CDCl3
Source File Reference UWVN30274