![16(S)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYLOXY]-22(S)-HYDROXYCHOLEST-4-EN-3-ONE](/api/spectrum/4JRidSMuMZY/structure.png?h=300&w=458 "16(S)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYLOXY]-22(S)-HYDROXYCHOLEST-4-EN-3-ONE")
| SpectraBase Compound ID | 33WMJjVwsEs |
|---|---|
| InChI | InChI=1S/C39H64O12/c1-18(2)7-10-26(42)19(3)29-27(16-25-23-9-8-21-15-22(41)11-13-38(21,5)24(23)12-14-39(25,29)6)49-37-35(33(46)31(44)28(17-40)50-37)51-36-34(47)32(45)30(43)20(4)48-36/h15,18-20,23-37,40,42-47H,7-14,16-17H2,1-6H3/t19-,20+,23?,24?,25?,26-,27+,28-,29+,30+,31+,32-,33+,34-,35-,36+,37-,38+,39+/m1/s1 |
| InChIKey | WAJUOVWZQFWDHS-FSBUJYFUSA-N |
| Mol Weight | 724.9 g/mol |
| Molecular Formula | C39H64O12 |
| Exact Mass | 724.439777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4JRidSMuMZY |
|---|---|
| Name | 16(S)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYLOXY]-22(S)-HYDROXYCHOLEST-4-EN-3-ONE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H64O12 |
| InChI | InChI=1S/C39H64O12/c1-18(2)7-10-26(42)19(3)29-27(16-25-23-9-8-21-15-22(41)11-13-38(21,5)24(23)12-14-39(25,29)6)49-37-35(33(46)31(44)28(17-40)50-37)51-36-34(47)32(45)30(43)20(4)48-36/h15,18-20,23-37,40,42-47H,7-14,16-17H2,1-6H3/t19-,20+,23?,24?,25?,26-,27+,28-,29+,30+,31+,32-,33+,34-,35-,36+,37-,38+,39+/m1/s1 |
| InChIKey | WAJUOVWZQFWDHS-FSBUJYFUSA-N |
| Literature Reference Author | H.ACHENBACH,H.HUEBNER,M.REITER |
| Literature Reference Citation | PHYTOCHEM.,41,907(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00622-2 |
| Molecular Weight | 724.930 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU4133 |