| SpectraBase Compound ID | GSUk9ktVT0 |
|---|---|
| InChI | InChI=1S/C39H46N2O17/c1-17-18(2)33(48)57-32-28(56-34(49)22-11-12-24(45)41(8)14-22)30(47)38(16-52-19(3)42)29(46)27(54-20(4)43)25-31(55-21(5)44)39(38,37(32,7)51)58-36(25,6)15-53-35(50)23-10-9-13-40-26(17)23/h9-14,17-18,25,27-32,46-47,51H,15-16H2,1-8H3/t17-,18-,25-,27+,28-,29-,30+,31-,32+,36+,37+,38-,39+/m1/s1 |
| InChIKey | LTLNQRCODBLXNO-YRHFQLLOSA-N |
| Mol Weight | 814.8 g/mol |
| Molecular Formula | C39H46N2O17 |
| Exact Mass | 814.279648 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BnP26XBZotP |
|---|---|
| Name | EMARGINATINE-E |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H46N2O17 |
| InChI | InChI=1S/C39H46N2O17/c1-17-18(2)33(48)57-32-28(56-34(49)22-11-12-24(45)41(8)14-22)30(47)38(16-52-19(3)42)29(46)27(54-20(4)43)25-31(55-21(5)44)39(38,37(32,7)51)58-36(25,6)15-53-35(50)23-10-9-13-40-26(17)23/h9-14,17-18,25,27-32,46-47,51H,15-16H2,1-8H3/t17-,18-,25-,27+,28-,29-,30+,31-,32+,36+,37+,38-,39+/m1/s1 |
| InChIKey | LTLNQRCODBLXNO-YRHFQLLOSA-N |
| Literature Reference Author | Y.H.KUO,C.H.CHEN,M.L.KING,T.S.WU,K.H.LEE |
| Literature Reference Citation | PHYTOCHEM.,35,803(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90610-1 |
| Molecular Weight | 814.797 g/mol |
| Solvent | Unknown |
| Source File Reference | UWLU25167 |