| SpectraBase Compound ID | F3sg07fD5Wg |
|---|---|
| InChI | InChI=1S/C37H60O10/c1-32(2)12-14-37(31(44)45-7)15-13-35(5)20(21(37)16-32)8-9-25-33(3)17-22(40)29(34(4,19-39)24(33)10-11-36(25,35)6)47-30-28(43)27(42)26(41)23(18-38)46-30/h8,21-30,38-43H,9-19H2,1-7H3/t21?,22-,23+,24?,25?,26+,27-,28+,29-,30-,33-,34-,35+,36+,37-/m0/s1 |
| InChIKey | JBVYXFKEJKMECF-YTJGAUBLSA-N |
| Mol Weight | 664.9 g/mol |
| Molecular Formula | C37H60O10 |
| Exact Mass | 664.418648 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6GSCwWPfRiy |
|---|---|
| Name | 3-O-BETA-D-GLUCOPYRANOSYL-BAYOGENIN_METHYLESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H60O10 |
| InChI | InChI=1S/C37H60O10/c1-32(2)12-14-37(31(44)45-7)15-13-35(5)20(21(37)16-32)8-9-25-33(3)17-22(40)29(34(4,19-39)24(33)10-11-36(25,35)6)47-30-28(43)27(42)26(41)23(18-38)46-30/h8,21-30,38-43H,9-19H2,1-7H3/t21?,22-,23+,24?,25?,26+,27-,28+,29-,30-,33-,34-,35+,36+,37-/m0/s1 |
| InChIKey | JBVYXFKEJKMECF-YTJGAUBLSA-N |
| Literature Reference Author | Y.SHAO,B.-N.ZHOU,K.MA,H.-M.WU |
| Literature Reference Citation | PLANTA.MED.,61,246(1995) |
| Literature Reference DOI | 10.1055/s-2006-958065 |
| Molecular Weight | 664.877 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UIAP691 |