| SpectraBase Compound ID | I86ebfWCCjI |
|---|---|
| InChI | InChI=1S/C31H48O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,16,20-21,23,25-28H,8,12-15,17-19H2,1-7H3/b10-9+/t21-,23+,25+,26+,27-,28+,30+,31-/m1/s1 |
| InChIKey | KAIHZONHIORXGA-DHPPOPHZSA-N |
| Mol Weight | 452.7 g/mol |
| Molecular Formula | C31H48O2 |
| Exact Mass | 452.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8iXL45GONmF |
|---|---|
| Name | 3-BETA-ACETOXY-24-BETA-ETHYLCHOLESTA-5,9(11),22E-TRIEN-3-BETA-OL |
| Compound Number | 2B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O2 |
| InChI | InChI=1S/C31H48O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,16,20-21,23,25-28H,8,12-15,17-19H2,1-7H3/b10-9+/t21-,23+,25+,26+,27-,28+,30+,31-/m1/s1 |
| InChIKey | KAIHZONHIORXGA-DHPPOPHZSA-N |
| Literature Reference Author | R.PANDEY,R.K.VERMA,S.C.SINGH,M.M.GUPTA |
| Literature Reference Citation | PHYTOCHEM.,63,415(2003) |
| Literature Reference DOI | 10.1016/s0031-9422(03)00146-8 |
| Molecular Weight | 452.721 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU29750 |