| SpectraBase Compound ID | KFE4pw2ezoQ |
|---|---|
| InChI | InChI=1S/C27H30O15/c1-36-13-5-9(3-4-12(13)29)17(30)10-6-27(42-24(10)35)16-15(21-22(27)40-21)11(23(34)37-2)8-38-25(16)41-26-20(33)19(32)18(31)14(7-28)39-26/h3-6,8,14-22,25-26,28-33H,7H2,1-2H3/t14-,15-,16-,17?,18-,19+,20-,21+,22+,25+,26+,27-/m1/s1 |
| InChIKey | YCKDJQYUDRMPHQ-IENXEMNPSA-N |
| Mol Weight | 594.52 g/mol |
| Molecular Formula | C27H30O15 |
| Exact Mass | 594.15847 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 11qFrhPnUoS |
|---|---|
| Name | EPOXYMETHOXYGAERTNEROSIDE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O15 |
| InChI | InChI=1S/C27H30O15/c1-36-13-5-9(3-4-12(13)29)17(30)10-6-27(42-24(10)35)16-15(21-22(27)40-21)11(23(34)37-2)8-38-25(16)41-26-20(33)19(32)18(31)14(7-28)39-26/h3-6,8,14-22,25-26,28-33H,7H2,1-2H3/t14-,15-,16-,17?,18-,19+,20-,21+,22+,25+,26+,27-/m1/s1 |
| InChIKey | YCKDJQYUDRMPHQ-IENXEMNPSA-N |
| Literature Reference Author | K.CIMANGA,N.HERMANS,S.APERS,S.VANMIERT,H.VANDERHEUVEL,M.CLAE YS,L.PIETERS,A.VLIET |
| Literature Reference Citation | J.NAT.PROD.,66,97(2003) |
| Literature Reference DOI | 10.1021/np020215h |
| Molecular Weight | 594.526 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWSI16697 |