![EXO-8-EXO-11-DI-(S)-VALINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL](/api/spectrum/fQotlOyV74/structure.png?h=300&w=458 "EXO-8-EXO-11-DI-(S)-VALINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL")
| SpectraBase Compound ID | KWnghWyJxRD |
|---|---|
| InChI | InChI=1S/C25H36N2O8/c1-8(2)20(22(30)31)26-12(28)6-24(34)16-10-5-11-15-14(10)18(24)19(15)25(35,17(11)16)7-13(29)27-21(9(3)4)23(32)33/h8-11,14-21,34-35H,5-7H2,1-4H3,(H,26,28)(H,27,29)(H,30,31)(H,32,33)/t10-,11+,14-,15-,16+,17-,18-,19-,20-,21-,24-,25-/m1/s1 |
| InChIKey | HWRLMRCTKGNUTF-MABCPRMKSA-N |
| Mol Weight | 492.6 g/mol |
| Molecular Formula | C25H36N2O8 |
| Exact Mass | 492.247166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | fQotlOyV74 |
|---|---|
| Name | EXO-8-EXO-11-DI-(S)-VALINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H36N2O8 |
| InChI | InChI=1S/C25H36N2O8/c1-8(2)20(22(30)31)26-12(28)6-24(34)16-10-5-11-15-14(10)18(24)19(15)25(35,17(11)16)7-13(29)27-21(9(3)4)23(32)33/h8-11,14-21,34-35H,5-7H2,1-4H3,(H,26,28)(H,27,29)(H,30,31)(H,32,33)/t10-,11+,14-,15-,16+,17-,18-,19-,20-,21-,24-,25-/m1/s1 |
| InChIKey | HWRLMRCTKGNUTF-MABCPRMKSA-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 | 492.569 g/mol |
| Source File Reference | UWIR4344 |