| SpectraBase Compound ID | 23RH4VviVBd |
|---|---|
| InChI | InChI=1S/C36H54O3/c1-6-26(25(3)23-39-34(38)27-10-8-7-9-11-27)13-12-24(2)31-16-17-32-30-15-14-28-22-29(37)18-20-35(28,4)33(30)19-21-36(31,32)5/h7-11,14,24-26,29-33,37H,6,12-13,15-23H2,1-5H3/t24-,25?,26+,29+,30?,31-,32?,33?,35+,36-/m1/s1 |
| InChIKey | BJZQJLWLEFGCBH-YTQINCSISA-N |
| Mol Weight | 534.8 g/mol |
| Molecular Formula | C36H54O3 |
| Exact Mass | 534.407296 g/mol |
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 | G5PP0DgqZB9 |
|---|---|
| Name | STIGMAST-5-EN-3-BETA,27-DIOL-27-BENZOATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H54O3 |
| InChI | InChI=1S/C36H54O3/c1-6-26(25(3)23-39-34(38)27-10-8-7-9-11-27)13-12-24(2)31-16-17-32-30-15-14-28-22-29(37)18-20-35(28,4)33(30)19-21-36(31,32)5/h7-11,14,24-26,29-33,37H,6,12-13,15-23H2,1-5H3/t24-,25?,26+,29+,30?,31-,32?,33?,35+,36-/m1/s1 |
| InChIKey | BJZQJLWLEFGCBH-YTQINCSISA-N |
| Literature Reference Author | X.SABA,M.H.MUGHAL,M.ALI,M.IQBAL,P.S.SRIVASTAVA |
| Literature Reference Citation | PHYTOCHEM.,50,1375(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00704-3 |
| Molecular Weight | 534.823 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN1627 |