| SpectraBase Compound ID | 1XCIVykyFWQ |
|---|---|
| InChI | InChI=1S/C26H28O14/c1-35-22(33)12-8-36-24(39-25-19(32)18(31)17(30)13(7-27)37-25)15-14(12)20-21(38-20)26(15)6-11(23(34)40-26)16(29)9-2-4-10(28)5-3-9/h2-6,8,13-21,24-25,27-32H,7H2,1H3/t13-,14-,15-,16+,17-,18+,19-,20+,21+,24+,25+,26-/m1/s1 |
| InChIKey | JFWOLYYFIRMHLG-NEQBHYGJSA-N |
| Mol Weight | 564.5 g/mol |
| Molecular Formula | C26H28O14 |
| Exact Mass | 564.147906 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DkkkiwWTXXd |
|---|---|
| Name | 13-R-EPI-EPOXYGAERTNEROSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H28O14 |
| InChI | InChI=1S/C26H28O14/c1-35-22(33)12-8-36-24(39-25-19(32)18(31)17(30)13(7-27)37-25)15-14(12)20-21(38-20)26(15)6-11(23(34)40-26)16(29)9-2-4-10(28)5-3-9/h2-6,8,13-21,24-25,27-32H,7H2,1H3/t13-,14-,15-,16+,17-,18+,19-,20+,21+,24+,25+,26-/m1/s1 |
| InChIKey | JFWOLYYFIRMHLG-NEQBHYGJSA-N |
| Literature Reference Author | J.SCHRIPSEMA,G.P.CAPRINI,R.VANDERHEIJDEN,R.BINO,R.DEVOS,D.DA GNINO |
| Literature Reference Citation | J.NAT.PROD.,70,1495(2007) |
| Literature Reference DOI | 10.1021/np070116+ |
| Molecular Weight | 564.500 g/mol |
| Sample ID | 31576 |
| Solvent | CD3OD |