| SpectraBase Compound ID | Ic0TDhOkfds |
|---|---|
| InChI | InChI=1S/C27H44O5/c1-14-7-8-27(31-13-14)15(2)24-22(32-27)10-19-17-6-5-16-9-20(28)21(29)12-25(16,3)18(17)11-23(30)26(19,24)4/h14-24,28-30H,5-13H2,1-4H3/t14-,15-,16+,17+,18-,19-,20+,21-,22-,23+,24-,25-,26+,27+/m0/s1 |
| InChIKey | IZSOKVKTMKUCGT-ZAXLBITDSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C27H44O5 |
| Exact Mass | 448.318875 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 | EcmhAhSPtgq |
|---|---|
| Name | 12-BETA-HYDROXY-SAMOGENIN;(25R)-2-BETA,3-BETA,12-BETA-TRIHYDROXY-5-BETA-SPIROSTANE |
| Compound Number | 49 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O5 |
| InChI | InChI=1S/C27H44O5/c1-14-7-8-27(31-13-14)15(2)24-22(32-27)10-19-17-6-5-16-9-20(28)21(29)12-25(16,3)18(17)11-23(30)26(19,24)4/h14-24,28-30H,5-13H2,1-4H3/t14-,15-,16+,17+,18-,19-,20+,21-,22-,23+,24-,25-,26+,27+/m0/s1 |
| InChIKey | IZSOKVKTMKUCGT-ZAXLBITDSA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,A.K.PATHAK |
| Literature Reference Citation | MAGN.RES.CHEM.,33,923(1995) |
| Literature Reference DOI | 10.1002/mrc.1260331202 |
| Molecular Weight | 448.643 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS22137 |