| SpectraBase Compound ID | 2pUGZ0cFbDa |
|---|---|
| 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-BJHNVLAPSA-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 | E5xm5xl9bJn |
|---|---|
| Name | EBULOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O10 |
| 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-BJHNVLAPSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,54,1173(1991) |
| Literature Reference DOI | 10.1021/np50077a001 |
| Molecular Weight | 444.479 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCS4389 |