| SpectraBase Compound ID | 5OX6B8Zv6bj |
|---|---|
| InChI | InChI=1S/C31H38O11/c1-15(32)40-20-13-29(5)19(10-23(35)42-25(29)17-8-9-39-14-17)18-12-31(37)26(36)30(6,24(18)20)21(11-22(34)38-7)28(3,4)27(31)41-16(2)33/h8-9,12,14,19-21,24-25,27,37H,10-11,13H2,1-7H3/t19-,20+,21-,24+,25-,27-,29+,30-,31-/m0/s1 |
| InChIKey | JKLCUPWPSAVXMO-VAAZOPOBSA-N |
| Mol Weight | 586.6 g/mol |
| Molecular Formula | C31H38O11 |
| Exact Mass | 586.241412 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 106BP5CQGbu |
|---|---|
| Name | 11-ALPHA-ACETOXY-2-ALPHA-HYDROXY-6-DEOXY-DESTIGLOYL-SWIETENINE-ACETATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H38O11 |
| InChI | InChI=1S/C31H38O11/c1-15(32)40-20-13-29(5)19(10-23(35)42-25(29)17-8-9-39-14-17)18-12-31(37)26(36)30(6,24(18)20)21(11-22(34)38-7)28(3,4)27(31)41-16(2)33/h8-9,12,14,19-21,24-25,27,37H,10-11,13H2,1-7H3/t19-,20+,21-,24+,25-,27-,29+,30-,31-/m0/s1 |
| InChIKey | JKLCUPWPSAVXMO-VAAZOPOBSA-N |
| Literature Reference Author | B.ZHANG,S.P.YANG,S.YIN,C.R.ZHANG,Y.WU,J.M.YUE |
| Literature Reference Citation | PHYTOCHEM.,70,1305(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.07.016 |
| Molecular Weight | 586.636 g/mol |
| Sample ID | 45625 |
| Solvent | C5D5N |