| SpectraBase Compound ID | HsP4JQExQSM |
|---|---|
| InChI | InChI=1S/C31H52O4/c1-8-22(19(2)3)10-9-20(4)24-11-12-25-28-26(14-15-29(24,25)6)30(7)16-13-23(35-21(5)33)17-31(30,34)27(28)18-32/h18-20,22-28,34H,8-17H2,1-7H3/t20-,22-,23+,24-,25+,26+,27-,28+,29-,30-,31-/m1/s1 |
| InChIKey | GQUFGTZBZKYTOI-TZHLKFFESA-N |
| Mol Weight | 488.8 g/mol |
| Molecular Formula | C31H52O4 |
| Exact Mass | 488.38656 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 | 8uSxSunh9OX |
|---|---|
| Name | 3-BETA-ACETOXY-5-BETA-HYDROXYL-6-BETA-FORMYL-B-NOR-SITOSTANE |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H52O4 |
| InChI | InChI=1S/C31H52O4/c1-8-22(19(2)3)10-9-20(4)24-11-12-25-28-26(14-15-29(24,25)6)30(7)16-13-23(35-21(5)33)17-31(30,34)27(28)18-32/h18-20,22-28,34H,8-17H2,1-7H3/t20-,22-,23+,24-,25+,26+,27-,28+,29-,30-,31-/m1/s1 |
| InChIKey | GQUFGTZBZKYTOI-TZHLKFFESA-N |
| Literature Reference Author | C.GAN,L.FAN,J.CUI,Y.HUANG,Y.JIAO,W.WEI |
| Literature Reference Citation | STEROIDS,77,1061(2012) |
| Literature Reference DOI | 10.1016/j.steroids.2012.05.005 |
| Molecular Weight | 488.751 g/mol |
| Sample ID | 70673 |
| Solvent | CDCl3 |