| SpectraBase Compound ID | 8naoHMTHjFh |
|---|---|
| InChI | InChI=1S/C41H48N2O18/c1-18-19(2)35(50)60-32-30(59-36(51)24-12-13-26(49)43(9)15-24)34(58-23(6)48)40(16-44)33(57-22(5)47)29(55-20(3)45)27-31(56-21(4)46)41(40,39(32,8)53)61-38(27,7)17-54-37(52)25-11-10-14-42-28(18)25/h10-15,18-19,27,29-34,44,53H,16-17H2,1-9H3/t18?,19?,27-,29+,30-,31+,32-,33+,34-,38+,39-,40+,41-/m0/s1 |
| InChIKey | COUXWUMISODJHQ-AUHDIFGISA-N |
| Mol Weight | 856.8 g/mol |
| Molecular Formula | C41H48N2O18 |
| Exact Mass | 856.290213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3wiSjA7ExUO |
|---|---|
| Name | EMARGINATINE-H |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H48N2O18 |
| InChI | InChI=1S/C41H48N2O18/c1-18-19(2)35(50)60-32-30(59-36(51)24-12-13-26(49)43(9)15-24)34(58-23(6)48)40(16-44)33(57-22(5)47)29(55-20(3)45)27-31(56-21(4)46)41(40,39(32,8)53)61-38(27,7)17-54-37(52)25-11-10-14-42-28(18)25/h10-15,18-19,27,29-34,44,53H,16-17H2,1-9H3/t18?,19?,27-,29+,30-,31+,32-,33+,34-,38+,39-,40+,41-/m0/s1 |
| InChIKey | COUXWUMISODJHQ-AUHDIFGISA-N |
| Literature Reference Author | Y.H.KUO,J.C.OU,K.H.LEE,C.F.CHEN |
| Literature Reference Citation | J.NAT.PROD.,58,1103(1995) |
| Literature Reference DOI | 10.1021/np50121a022 |
| Molecular Weight | 856.835 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP6677 |