| SpectraBase Compound ID | 70TRA64jeYs |
|---|---|
| InChI | InChI=1S/C21H30O13/c1-7-12-13(18(32-9(3)24)17(7)31-8(2)23)10(19(28)29-4)6-30-20(12)34-21-16(27)15(26)14(25)11(5-22)33-21/h6-7,11-18,20-22,25-27H,5H2,1-4H3/t7-,11-,12?,13?,14-,15+,16-,17+,18-,20-,21+/m1/s1 |
| InChIKey | LBSSFVCNVYMGJT-JFZSERLBSA-N |
| Mol Weight | 490.46 g/mol |
| Molecular Formula | C21H30O13 |
| Exact Mass | 490.168641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8F8BxM6M1FH |
|---|---|
| Name | BARBATOSIDE |
| Compound Number | 235 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O13 |
| InChI | InChI=1S/C21H30O13/c1-7-12-13(18(32-9(3)24)17(7)31-8(2)23)10(19(28)29-4)6-30-20(12)34-21-16(27)15(26)14(25)11(5-22)33-21/h6-7,11-18,20-22,25-27H,5H2,1-4H3/t7-,11-,12?,13?,14-,15+,16-,17+,18-,20-,21+/m1/s1 |
| InChIKey | LBSSFVCNVYMGJT-JFZSERLBSA-N |
| Literature Reference Author | C.A.BOROS,F.R.STERMITZ |
| Literature Reference Citation | J.NAT.PROD.,53,1055(1990) |
| Literature Reference DOI | 10.1021/np50071a001 |
| Molecular Weight | 490.461 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ16206 |