| SpectraBase Compound ID | Lj2GHbUbIxC |
|---|---|
| InChI | InChI=1S/C21H32O10/c1-9(2)4-15(24)31-20-16-10(3)13(23)5-12(16)11(7-28-20)8-29-21-19(27)18(26)17(25)14(6-22)30-21/h7,9-10,12,14,16-22,25-27H,4-6,8H2,1-3H3/t10-,12+,14+,16+,17+,18-,19+,20-,21+/m0/s1 |
| InChIKey | XKQWFBQKSSYGBS-WPHWWJDCSA-N |
| Mol Weight | 444.5 g/mol |
| Molecular Formula | C21H32O10 |
| Exact Mass | 444.199547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6vCy5rP8SfA |
|---|---|
| Name | EBULOSIDE |
| Compound Number | 90 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C21H32O10/c1-9(2)4-15(24)31-20-16-10(3)13(23)5-12(16)11(7-28-20)8-29-21-19(27)18(26)17(25)14(6-22)30-21/h7,9-10,12,14,16-22,25-27H,4-6,8H2,1-3H3/t10-,12+,14+,16+,17+,18-,19+,20-,21+/m0/s1 |
| InChIKey | XKQWFBQKSSYGBS-WPHWWJDCSA-N |
| Literature Reference | NAT.PROD.VOL.1 A.UR-RAHMAN,V.U.AHMAD |
| Solvent | Methanol-d4 |