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

*Links on SpectraBase are not permalinks.

(1S,2S,3R,4R)-1,4-BIS-O-(BENZOYL)-2-[(3R)-HYDROXYPENT-1-(1E)-ENYL]-3-(METHOXYCARBONYLHEPTYL)-CYCLOPENTANE-1,4-DIOL

View entire compound with spectra: 1 NMR

(1S,2S,3R,4R)-1,4-BIS-O-(BENZOYL)-2-[(3R)-HYDROXYPENT-1-(1E)-ENYL]-3-(METHOXYCARBONYLHEPTYL)-CYCLOPENTANE-1,4-DIOL
SpectraBase Compound ID FoHFQQjHIIG
InChI InChI=1S/C33H42O7/c1-3-26(34)21-22-28-27(19-13-5-4-6-14-20-31(35)38-2)29(39-32(36)24-15-9-7-10-16-24)23-30(28)40-33(37)25-17-11-8-12-18-25/h7-12,15-18,21-22,26-30,34H,3-6,13-14,19-20,23H2,1-2H3/b22-21+/t26-,27-,28+,29-,30+/m1/s1
InChIKey WSQRGIFCZACZIR-PUGPGJGZSA-N
Mol Weight 550.7 g/mol
Molecular Formula C33H42O7
Exact Mass 550.293054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ba5kYv3qu1A
Name (1S,2S,3R,4R)-1,4-BIS-O-(BENZOYL)-2-[(3R)-HYDROXYPENT-1-(1E)-ENYL]-3-(METHOXYCARBONYLHEPTYL)-CYCLOPENTANE-1,4-DIOL
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H42O7
InChI InChI=1S/C33H42O7/c1-3-26(34)21-22-28-27(19-13-5-4-6-14-20-31(35)38-2)29(39-32(36)24-15-9-7-10-16-24)23-30(28)40-33(37)25-17-11-8-12-18-25/h7-12,15-18,21-22,26-30,34H,3-6,13-14,19-20,23H2,1-2H3/b22-21+/t26-,27-,28+,29-,30+/m1/s1
InChIKey WSQRGIFCZACZIR-PUGPGJGZSA-N
Literature Reference Author S.E.FANGOUR,A.GUY,V.DESPRES,J.P.VIDAL,J.C.ROSSI,T.DURAND
Literature Reference Citation J.ORG.CHEM.,69,2498(2004)
Literature Reference DOI 10.1021/jo035638i
Molecular Weight 550.692 g/mol
Solvent CDCl3
Source File Reference UWVN21276