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EXO-8-EXO-11-DIPHENYL-(S)-ALANINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL
SpectraBase Compound ID AjcbBKQTPZv
InChI InChI=1S/C33H36N2O8/c36-22(34-20(30(38)39)11-16-7-3-1-4-8-16)14-32(42)26-18-13-19-25-24(18)28(32)29(25)33(43,27(19)26)15-23(37)35-21(31(40)41)12-17-9-5-2-6-10-17/h1-10,18-21,24-29,42-43H,11-15H2,(H,34,36)(H,35,37)(H,38,39)(H,40,41)/t18-,19+,20-,21-,24-,25-,26+,27-,28-,29-,32-,33-/m1/s1
InChIKey ZAWFTZALOMZTLH-GBKFVLEHSA-N
Mol Weight 588.7 g/mol
Molecular Formula C33H36N2O8
Exact Mass 588.247166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4dLFNlqdiE5
Name EXO-8-EXO-11-DIPHENYL-(S)-ALANINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H36N2O8
InChI InChI=1S/C33H36N2O8/c36-22(34-20(30(38)39)11-16-7-3-1-4-8-16)14-32(42)26-18-13-19-25-24(18)28(32)29(25)33(43,27(19)26)15-23(37)35-21(31(40)41)12-17-9-5-2-6-10-17/h1-10,18-21,24-29,42-43H,11-15H2,(H,34,36)(H,35,37)(H,38,39)(H,40,41)/t18-,19+,20-,21-,24-,25-,26+,27-,28-,29-,32-,33-/m1/s1
InChIKey ZAWFTZALOMZTLH-GBKFVLEHSA-N
Literature Reference Author R.KARPOORMATH,O.K.ONAJOLE,T.NAICKER,T.GOVENDER,G.E.M.MAGUIRE ,H.G.KRUGER
Literature Reference Citation S.AFR.J.CHEM.,65,108(2012)
Molecular Weight 588.657 g/mol
Source File Reference UWIR4343