| SpectraBase Compound ID | LthjaRglxQP |
|---|---|
| InChI | InChI=1S/C40H48O18/c1-8-31-32-17-30(16-27(47)15-29(52-22(4)43)14-11-26-9-12-28(13-10-26)51-21(3)42)56-38(48)33(32)18-50-39(31)58-40-37(55-25(7)46)36(54-24(6)45)35(53-23(5)44)34(57-40)19-49-20(2)41/h8-10,12-13,18,29-32,34-37,39-40H,1,11,14-17,19H2,2-7H3/t29-,30+,31-,32+,34+,35+,36-,37+,39+,40-/m0/s1 |
| InChIKey | LMDJQLLAPARITB-CBZVGEEKSA-N |
| Mol Weight | 816.8 g/mol |
| Molecular Formula | C40H48O18 |
| Exact Mass | 816.284065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9fg4wEFH3Dd |
|---|---|
| Name | HYDRAMACROSIDE-A-HEXAACETATE |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H48O18 |
| InChI | InChI=1S/C40H48O18/c1-8-31-32-17-30(16-27(47)15-29(52-22(4)43)14-11-26-9-12-28(13-10-26)51-21(3)42)56-38(48)33(32)18-50-39(31)58-40-37(55-25(7)46)36(54-24(6)45)35(53-23(5)44)34(57-40)19-49-20(2)41/h8-10,12-13,18,29-32,34-37,39-40H,1,11,14-17,19H2,2-7H3/t29-,30+,31-,32+,34+,35+,36-,37+,39+,40-/m0/s1 |
| InChIKey | LMDJQLLAPARITB-CBZVGEEKSA-N |
| Literature Reference Author | H.MATSUDA,H.SHIMODA,T.UEMURA,T.UEDA,J.YAMAHARA,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,47,1753(1999) |
| Literature Reference DOI | 10.1248/cpb.47.1753 |
| Molecular Weight | 816.810 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU8462 |