![EXO-8-EXO-11-DI-(S)-2-PHENYLGLYCINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL](/api/spectrum/HZItNxhtxBG/structure.png?h=300&w=458 "EXO-8-EXO-11-DI-(S)-2-PHENYLGLYCINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL")
| SpectraBase Compound ID | BnyLT88ZLaw |
|---|---|
| InChI | InChI=1S/C31H32N2O8/c34-18(32-26(28(36)37)14-7-3-1-4-8-14)12-30(40)22-16-11-17-21-20(16)24(30)25(21)31(41,23(17)22)13-19(35)33-27(29(38)39)15-9-5-2-6-10-15/h1-10,16-17,20-27,40-41H,11-13H2,(H,32,34)(H,33,35)(H,36,37)(H,38,39)/t16-,17+,20-,21-,22+,23-,24-,25-,26-,27-,30-,31+/m1/s1 |
| InChIKey | QTERSSITGOVAHF-HGJRPLOJSA-N |
| Mol Weight | 560.6 g/mol |
| Molecular Formula | C31H32N2O8 |
| Exact Mass | 560.215866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HZItNxhtxBG |
|---|---|
| Name | EXO-8-EXO-11-DI-(S)-2-PHENYLGLYCINE-PENTACYCLO-[5.4.0.0(2,6).0(3,10).0(5,9)]-UNDECANE-ENDO-8-ENDO-11-DIOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H32N2O8 |
| InChI | InChI=1S/C31H32N2O8/c34-18(32-26(28(36)37)14-7-3-1-4-8-14)12-30(40)22-16-11-17-21-20(16)24(30)25(21)31(41,23(17)22)13-19(35)33-27(29(38)39)15-9-5-2-6-10-15/h1-10,16-17,20-27,40-41H,11-13H2,(H,32,34)(H,33,35)(H,36,37)(H,38,39)/t16-,17+,20-,21-,22+,23-,24-,25-,26-,27-,30-,31+/m1/s1 |
| InChIKey | QTERSSITGOVAHF-HGJRPLOJSA-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 | 560.604 g/mol |
| Source File Reference | UWIR4345 |