| SpectraBase Compound ID | 4Kt40DZZMSR |
|---|---|
| InChI | InChI=1S/C34H52O8/c1-19(2)20(3)10-11-21(4)26-12-13-27-28-16-29(41-23(6)36)33(38)17-25(40-22(5)35)14-15-32(33,9)34(28,39)30(42-24(7)37)18-31(26,27)8/h16,19,21,25-27,29-30,38-39H,3,10-15,17-18H2,1-2,4-9H3/t21-,25+,26-,27+,29+,30-,31-,32+,33+,34+/m1/s1 |
| InChIKey | IUGVZOVBFORLBP-DXJOVEPHSA-N |
| Mol Weight | 588.8 g/mol |
| Molecular Formula | C34H52O8 |
| Exact Mass | 588.366219 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LtTNKFRxmgT |
|---|---|
| Name | 3-BETA,6-ALPHA,11-ALPHA-TRIACETOXY-24-METHYLENE-5-ALPHA-CHOLEST-7-ENE-5,9-ALPHA-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H52O8 |
| InChI | InChI=1S/C34H52O8/c1-19(2)20(3)10-11-21(4)26-12-13-27-28-16-29(41-23(6)36)33(38)17-25(40-22(5)35)14-15-32(33,9)34(28,39)30(42-24(7)37)18-31(26,27)8/h16,19,21,25-27,29-30,38-39H,3,10-15,17-18H2,1-2,4-9H3/t21-,25+,26-,27+,29+,30-,31-,32+,33+,34+/m1/s1 |
| InChIKey | IUGVZOVBFORLBP-DXJOVEPHSA-N |
| Literature Reference Author | S.ISAACS,R.BERMAN,Y.KASHMAN,T.GEBREYESUS,T.YOSIEF |
| Literature Reference Citation | J.NAT.PROD.,54,83(1991) |
| Literature Reference DOI | 10.1021/np50073a004 |
| Molecular Weight | 588.782 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS16 |