| SpectraBase Compound ID | 3SZ02nK5Qpr |
|---|---|
| InChI | InChI=1S/C29H42O9/c1-14-8-23(31)29(34)25(36-14)37-20-10-16-4-5-18-17(26(16,2)12-21(20)38-29)6-7-27(3)19(11-22(30)28(18,27)33)15-9-24(32)35-13-15/h9,14,16-23,25,30-31,33-34H,4-8,10-13H2,1-3H3/t14-,16+,17+,18-,19-,20-,21-,22-,23+,25+,26+,27-,28-,29+/m1/s1 |
| InChIKey | HNOFNBVWCFKUEQ-GMPNGYBSSA-N |
| Mol Weight | 534.6 g/mol |
| Molecular Formula | C29H42O9 |
| Exact Mass | 534.282883 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5ToXqE5yh40 |
|---|---|
| Name | 3'-EPIAFROSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O9 |
| InChI | InChI=1S/C29H42O9/c1-14-8-23(31)29(34)25(36-14)37-20-10-16-4-5-18-17(26(16,2)12-21(20)38-29)6-7-27(3)19(11-22(30)28(18,27)33)15-9-24(32)35-13-15/h9,14,16-23,25,30-31,33-34H,4-8,10-13H2,1-3H3/t14-,16+,17+,18-,19-,20-,21-,22-,23+,25+,26+,27-,28-,29+/m1/s1 |
| InChIKey | HNOFNBVWCFKUEQ-GMPNGYBSSA-N |
| Literature Reference Author | H.EL-ASKARY,J.HOELZL,S.HILAL,E.EL-KASHOURY |
| Literature Reference Citation | PHYTOCHEM.,34,1399(1993) |
| Literature Reference DOI | 10.1016/0031-9422(91)80037-2 |
| Molecular Weight | 534.647 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU20679 |