| SpectraBase Compound ID | A0wFmhNN6s8 |
|---|---|
| InChI | InChI=1S/C28H46O3/c1-17(2)18(3)11-16-28(6,31)24-10-9-20-19-7-8-22-25(30)23(29)13-15-26(22,4)21(19)12-14-27(20,24)5/h8,17,19-21,23-25,29-31H,3,7,9-16H2,1-2,4-6H3/t19?,20?,21?,23-,24?,25+,26+,27-,28+/m0/s1 |
| InChIKey | BHAJTNJZYVSPOE-JTTNDXRYSA-N |
| Mol Weight | 430.7 g/mol |
| Molecular Formula | C28H46O3 |
| Exact Mass | 430.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | f5pppVrE0U |
|---|---|
| Name | ERGOSTA-5,24(24')-DIENE-3-BETA,4-BETA,20-BETA-TRIOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H46O3 |
| InChI | InChI=1S/C28H46O3/c1-17(2)18(3)11-16-28(6,31)24-10-9-20-19-7-8-22-25(30)23(29)13-15-26(22,4)21(19)12-14-27(20,24)5/h8,17,19-21,23-25,29-31H,3,7,9-16H2,1-2,4-6H3/t19?,20?,21?,23-,24?,25+,26+,27-,28+/m0/s1 |
| InChIKey | BHAJTNJZYVSPOE-JTTNDXRYSA-N |
| Literature Reference Author | T.R.GOVINDACHARI,G.N.K.KUMARI,G.SURESH |
| Literature Reference Citation | PHYTOCHEM.,44,153(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00462-1 |
| Molecular Weight | 430.671 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPA37 |