| SpectraBase Compound ID | KU2rIcmOfvN |
|---|---|
| InChI | InChI=1S/C33H52O5/c1-20(18-23(35)19-21(2)29(36)37-9)24-12-16-33(8)26-10-11-27-30(4,5)28(38-22(3)34)14-15-31(27,6)25(26)13-17-32(24,33)7/h10,20-21,24-25,27-28H,11-19H2,1-9H3/t20-,21-,24-,25+,27+,28+,31-,32-,33+/m1/s1 |
| InChIKey | KSABNVUMGNYNHH-NLAZZITDSA-N |
| Mol Weight | 528.8 g/mol |
| Molecular Formula | C33H52O5 |
| Exact Mass | 528.381475 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KUvNX1z1sZn |
|---|---|
| Name | METHYL-(25R)-3-ALPHA-ACETOXY-23-OXO-9-BETA-LANOST-7-EN-26-OATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H52O5 |
| InChI | InChI=1S/C33H52O5/c1-20(18-23(35)19-21(2)29(36)37-9)24-12-16-33(8)26-10-11-27-30(4,5)28(38-22(3)34)14-15-31(27,6)25(26)13-17-32(24,33)7/h10,20-21,24-25,27-28H,11-19H2,1-9H3/t20-,21-,24-,25+,27+,28+,31-,32-,33+/m1/s1 |
| InChIKey | KSABNVUMGNYNHH-NLAZZITDSA-N |
| Literature Reference Author | A.F.BARRERO,J.F.SANCHEZ,E.J.ALVAREZ-MANZANEDA,M.M.DORADO,A.H AIDOUR |
| Literature Reference Citation | PHYTOCHEM.,30,593(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83732-Z |
| Molecular Weight | 528.773 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI25329 |