| SpectraBase Compound ID | GaedUB7j4pt |
|---|---|
| InChI | InChI=1S/C29H52O10S.Na/c1-6-17(28(5,34)15-39-40(36,37)38)8-7-16(2)22-24(32)25(33)23-19-13-21(31)29(35)14-18(30)9-12-27(29,4)20(19)10-11-26(22,23)3;/h16-25,30-35H,6-15H2,1-5H3,(H,36,37,38);/q;+1/p-1/t16-,17-,18+,19-,20+,21-,22+,23-,24-,25-,26-,27-,28+,29+;/m1./s1 |
| InChIKey | DADYPSUUDXPKON-VIEJQDODSA-M |
| Mol Weight | 614.8 g/mol |
| Molecular Formula | C29H51NaO10S |
| Exact Mass | 614.310063 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3xbXlkOyeKQ |
|---|---|
| Name | 24-ETHYL-5-ALPHA-CHOLESTANE-3-BETA,5,6-BETA,15-ALPHA,16-BETA,25,26-HEPTOL-26-SULFATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H51NaO10S |
| InChI | InChI=1S/C29H52O10S.Na/c1-6-17(28(5,34)15-39-40(36,37)38)8-7-16(2)22-24(32)25(33)23-19-13-21(31)29(35)14-18(30)9-12-27(29,4)20(19)10-11-26(22,23)3;/h16-25,30-35H,6-15H2,1-5H3,(H,36,37,38);/q;+1/p-1/t16-,17-,18+,19-,20+,21-,22+,23-,24-,25-,26-,27-,28+,29+;/m1./s1 |
| InChIKey | DADYPSUUDXPKON-VIEJQDODSA-M |
| Literature Reference Author | F.DERICCARDIS,I.IZZO,M.IORIZZI,E.PALAGIANO,L.MINALE,R.RICCIO |
| Literature Reference Citation | J.NAT.PROD.,59,386(1996) |
| Literature Reference DOI | 10.1021/np9601061 |
| Molecular Weight | 614.768 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP2421 |