| SpectraBase Compound ID | JBErMRBhGVR |
|---|---|
| InChI | InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(30)16-21(28)17-26(27)31/h17,19-20,22-25,27,30H,2,7-16H2,1,3-6H3/t19-,20-,22+,23-,24+,25+,27+,28+,29-/m1/s1 |
| InChIKey | HBBIPORYGNULJF-ZIHMWMKCSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C29H46O2 |
| Exact Mass | 426.349781 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Fz7czgbEjY |
|---|---|
| Name | 3-BETA-HYDROXY-24-ALPHA-ETHYLCHOLESTA-5,25-DIEN-7-ONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O2 |
| InChI | InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-27-25(13-15-29(23,24)6)28(5)14-12-22(30)16-21(28)17-26(27)31/h17,19-20,22-25,27,30H,2,7-16H2,1,3-6H3/t19-,20-,22+,23-,24+,25+,27+,28+,29-/m1/s1 |
| InChIKey | HBBIPORYGNULJF-ZIHMWMKCSA-N |
| Literature Reference Author | A.ULUBELEN,G.TOPCU,UE.KAYA |
| Literature Reference Citation | PHYTOCHEM.,36,171(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)97033-X |
| Molecular Weight | 426.683 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU25935 |