| SpectraBase Compound ID | 6HSiB0jSQ8A |
|---|---|
| InChI | InChI=1S/C27H46O3/c1-18(2)7-6-8-19(3)21-9-10-22-24(21,4)13-12-23-25(5)14-11-20(28)17-26(25,29)15-16-27(22,23)30/h15-16,18-23,28-30H,6-14,17H2,1-5H3/t19-,20+,21-,22+,23-,24-,25-,26-,27+/m1/s1 |
| InChIKey | PZFKMXUOAPXMRJ-ZIWPDNFOSA-N |
| Mol Weight | 418.7 g/mol |
| Molecular Formula | C27H46O3 |
| Exact Mass | 418.344695 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 | 4fHZsjyT0hy |
|---|---|
| Name | CHOLEST-7-EN-3,5,7-TRIOL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H46O3 |
| InChI | InChI=1S/C27H46O3/c1-18(2)7-6-8-19(3)21-9-10-22-24(21,4)13-12-23-25(5)14-11-20(28)17-26(25,29)15-16-27(22,23)30/h15-16,18-23,28-30H,6-14,17H2,1-5H3/t19-,20+,21-,22+,23-,24-,25-,26-,27+/m1/s1 |
| InChIKey | PZFKMXUOAPXMRJ-ZIWPDNFOSA-N |
| Literature Reference Author | A.W.W.VANWYK,C.A.GRAY,C.E.WHIBLEY,O.OSONIYI,D.T.HENDRICKS,M. R.CAIRA,M.T.DAVIES-C |
| Literature Reference Citation | J.NAT.PROD.,71,420(2008) |
| Literature Reference DOI | 10.1021/np070612y |
| Molecular Weight | 418.660 g/mol |
| Sample ID | 27313 |
| Solvent | CDCl3 |