| SpectraBase Compound ID | Lg5mLuiekIG |
|---|---|
| InChI | InChI=1S/C21H32O9/c1-10-12-6-5-11(4-3-7-21(2)18(30-21)17(12)29-19(10)26)9-27-20-16(25)15(24)14(23)13(8-22)28-20/h4,10,12-18,20,22-25H,3,5-9H2,1-2H3/b11-4+/t10-,12-,13+,14+,15-,16+,17-,18+,20+,21+/m0/s1 |
| InChIKey | PPEZJRDHOXFQGZ-RGQSQJAASA-N |
| Mol Weight | 428.5 g/mol |
| Molecular Formula | C21H32O9 |
| Exact Mass | 428.204633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 11DQ2YtKpzG |
|---|---|
| Name | 11-BETA,13-DIHYDROPARTHENOLIDE-14-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O9 |
| InChI | InChI=1S/C21H32O9/c1-10-12-6-5-11(4-3-7-21(2)18(30-21)17(12)29-19(10)26)9-27-20-16(25)15(24)14(23)13(8-22)28-20/h4,10,12-18,20,22-25H,3,5-9H2,1-2H3/b11-4+/t10-,12-,13+,14+,15-,16+,17-,18+,20+,21+/m0/s1 |
| InChIKey | PPEZJRDHOXFQGZ-RGQSQJAASA-N |
| Literature Reference Author | M.P.KOTSOS,N.ALIGIANNIS,V.MYRIANTHOPOULOS,S.MITAKU,L.SKALTSO UNIS |
| Literature Reference Citation | J.NAT.PROD.,71,847(2008) |
| Literature Reference DOI | 10.1021/np070252e |
| Molecular Weight | 428.480 g/mol |
| Sample ID | 28289 |
| Solvent | CD3OD |