| SpectraBase Compound ID | JXNGzCO5vxL |
|---|---|
| InChI | InChI=1S/C30H50O3/c1-17(2)19(4)28(6)16-25(28)18(3)22-8-9-23-21-14-26(32)30(33)15-20(31)10-13-29(30,7)24(21)11-12-27(22,23)5/h17-25,31,33H,8-16H2,1-7H3/t18-,19+,20+,21-,22+,23-,24-,25+,27+,28+,29+,30+/m0/s1 |
| InChIKey | JBUBDYUATMEXOL-PWGYGRRPSA-N |
| Mol Weight | 458.7 g/mol |
| Molecular Formula | C30H50O3 |
| Exact Mass | 458.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Csmj57DRt0p |
|---|---|
| Name | 3-ALPHA,5-BETA-DIHYDROXY-GORGOSTAN-6-ONE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O3 |
| InChI | InChI=1S/C30H50O3/c1-17(2)19(4)28(6)16-25(28)18(3)22-8-9-23-21-14-26(32)30(33)15-20(31)10-13-29(30,7)24(21)11-12-27(22,23)5/h17-25,31,33H,8-16H2,1-7H3/t18-,19+,20+,21-,22+,23-,24-,25+,27+,28+,29+,30+/m0/s1 |
| InChIKey | JBUBDYUATMEXOL-PWGYGRRPSA-N |
| Literature Reference Author | M.Y.PUTRA,G.BAVESTRELLO,C.CERRANO,B.RENGA,C.DAMORE,S.FIORUCC I,E.FATTORUSSO,O.TAG |
| Literature Reference Citation | STEROIDS,77,433(2012) |
| Literature Reference DOI | 10.1016/j.steroids.2011.12.026 |
| Molecular Weight | 458.725 g/mol |
| Sample ID | 70586 |
| Solvent | CDCl3 |