| SpectraBase Compound ID | 5PCuQtTVP9Y |
|---|---|
| InChI | InChI=1S/C42H50O19/c1-8-33-34-18-32(17-29(50)16-31(55-23(4)45)15-28(49)12-9-27-10-13-30(14-11-27)54-22(3)44)59-40(51)35(34)19-53-41(33)61-42-39(58-26(7)48)38(57-25(6)47)37(56-24(5)46)36(60-42)20-52-21(2)43/h8,10-11,13-14,19,31-34,36-39,41-42H,1,9,12,15-18,20H2,2-7H3/t31-,32+,33-,34+,36+,37+,38-,39+,41+,42-/m0/s1 |
| InChIKey | NTXZEPDGMBNWQO-HPCNQKBWSA-N |
| Mol Weight | 858.8 g/mol |
| Molecular Formula | C42H50O19 |
| Exact Mass | 858.294629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6H9YFpg8g5K |
|---|---|
| Name | HYDRAMACROSIDE-B-HEXAACETATE |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H50O19 |
| InChI | InChI=1S/C42H50O19/c1-8-33-34-18-32(17-29(50)16-31(55-23(4)45)15-28(49)12-9-27-10-13-30(14-11-27)54-22(3)44)59-40(51)35(34)19-53-41(33)61-42-39(58-26(7)48)38(57-25(6)47)37(56-24(5)46)36(60-42)20-52-21(2)43/h8,10-11,13-14,19,31-34,36-39,41-42H,1,9,12,15-18,20H2,2-7H3/t31-,32+,33-,34+,36+,37+,38-,39+,41+,42-/m0/s1 |
| InChIKey | NTXZEPDGMBNWQO-HPCNQKBWSA-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 | 858.848 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU8468 |