| SpectraBase Compound ID | HsAQwS6MxiR |
|---|---|
| InChI | InChI=1S/C29H48O3/c1-17(2)18(3)19(4)25(31)28(7)29(32-28)15-12-24-22-9-8-20-16-21(30)10-13-26(20,5)23(22)11-14-27(24,29)6/h8,17-19,21-25,30-31H,9-16H2,1-7H3/t18?,19?,21-,22?,23?,24?,25?,26-,27-,28-,29-/m0/s1 |
| InChIKey | CIBBJGAKYYGAAG-JGLNLENWSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C29H48O3 |
| Exact Mass | 444.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LSIB4G6cSBA |
|---|---|
| Name | 17-BETA,20-BETA-EPOXY-23,24-DIMETHYL-CHOLEST-5-ENE-3-BETA,22-DIOL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H48O3 |
| InChI | InChI=1S/C29H48O3/c1-17(2)18(3)19(4)25(31)28(7)29(32-28)15-12-24-22-9-8-20-16-21(30)10-13-26(20,5)23(22)11-14-27(24,29)6/h8,17-19,21-25,30-31H,9-16H2,1-7H3/t18?,19?,21-,22?,23?,24?,25?,26-,27-,28-,29-/m0/s1 |
| InChIKey | CIBBJGAKYYGAAG-JGLNLENWSA-N |
| Literature Reference Author | A.S.R.ANJANEYULU,M.V.R.K.MURTHY,P.M.GOWRI |
| Literature Reference Citation | J.NAT.PROD.,63,112(2000) |
| Literature Reference DOI | 10.1021/np990205p |
| Molecular Weight | 444.698 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU1748 |