| SpectraBase Compound ID | DYM2sc56dBx |
|---|---|
| InChI | InChI=1S/C21H32O13/c1-7-13(24)15(26)17(28)20(31-7)32-10-4-8(5-22)12-9(10)2-3-30-19(12)34-21-18(29)16(27)14(25)11(6-23)33-21/h2-4,7,9-29H,5-6H2,1H3/t7-,9+,10-,11+,12-,13-,14+,15+,16-,17+,18+,19+,20-,21-/m1/s1 |
| InChIKey | GKYZLSXVWCJFOK-YFESKRLCSA-N |
| Mol Weight | 492.5 g/mol |
| Molecular Formula | C21H32O13 |
| Exact Mass | 492.184291 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1KSueXkKZ5s |
|---|---|
| Name | SINUATOL;6-O-ALPHA-L-RHAMNOPYRANOSYLAUCUBIN |
| Compound Number | 68 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O13 |
| InChI | InChI=1S/C21H32O13/c1-7-13(24)15(26)17(28)20(31-7)32-10-4-8(5-22)12-9(10)2-3-30-19(12)34-21-18(29)16(27)14(25)11(6-23)33-21/h2-4,7,9-29H,5-6H2,1H3/t7-,9+,10-,11+,12-,13-,14+,15+,16-,17+,18+,19+,20-,21-/m1/s1 |
| InChIKey | GKYZLSXVWCJFOK-YFESKRLCSA-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 | 492.477 g/mol |
| Solvent | D2O |
| Source File Reference | UWMZ16062 |