| SpectraBase Compound ID | GkB9apx4II2 |
|---|---|
| InChI | InChI=1S/C43H64O5/c1-36-17-9-30-40(5)15-7-13-38(3,28(40)11-19-42(30,24-36)22-21-36)26-46-32(44)23-33(45)47-27-39(4)14-8-16-41(6)29(39)12-20-43-25-37(2,18-10-31(41)43)34-35(43)48-34/h21-22,28-31,34-35H,7-20,23-27H2,1-6H3/t28-,29-,30+,31+,34?,35?,36-,37+,38+,39+,40-,41-,42+,43+/m1/s1 |
| InChIKey | VOQLSQHLEMNZIF-RVACXXEWSA-N |
| Mol Weight | 661.0 g/mol |
| Molecular Formula | C43H64O5 |
| Exact Mass | 660.475375 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2e5Xr9doEA7 |
|---|---|
| Name | ENT-BEYER-15-EN-19-OL;15-BETA,16-BETA-EPOXIDE-ENT-BEYERAN-MALONIC-ACID-19-OL-DIESTER |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H64O5 |
| InChI | InChI=1S/C43H64O5/c1-36-17-9-30-40(5)15-7-13-38(3,28(40)11-19-42(30,24-36)22-21-36)26-46-32(44)23-33(45)47-27-39(4)14-8-16-41(6)29(39)12-20-43-25-37(2,18-10-31(41)43)34-35(43)48-34/h21-22,28-31,34-35H,7-20,23-27H2,1-6H3/t28-,29-,30+,31+,34?,35?,36-,37+,38+,39+,40-,41-,42+,43+/m1/s1 |
| InChIKey | VOQLSQHLEMNZIF-RVACXXEWSA-N |
| Literature Reference Author | S.E.DREWES,K.E.MUDAU,S.F.V.VUUREN,A.M.VILJOEN |
| Literature Reference Citation | PHYTOCHEM.,67,716(2006) |
| Literature Reference DOI | 10.1016/j.phytochem.2005.12.015 |
| Molecular Weight | 660.978 g/mol |
| Sample ID | 66129 |
| Solvent | CDCl3 |