| SpectraBase Compound ID | IaP6oSmmHj1 |
|---|---|
| InChI | InChI=1S/C48H78O16/c1-22-30(51)33(54)36(57)39(59-22)63-38-35(56)32(53)24(20-49)61-41(38)64-37-34(55)31(52)23(2)60-40(37)62-29-12-13-44(7)25(43(29,5)6)10-14-45(8)26(44)11-15-48-27-18-42(3,4)16-17-47(27,21-58-48)28(50)19-46(45,48)9/h11,15,22-41,49-57H,10,12-14,16-21H2,1-9H3/t22-,23+,24+,25?,26?,27?,28+,29-,30-,31-,32+,33+,34-,35-,36+,37+,38+,39-,40-,41-,44-,45+,46-,47+,48-/m0/s1 |
| InChIKey | HMEMJYQIFNQSFR-OULLDVHZSA-N |
| Mol Weight | 911.1 g/mol |
| Molecular Formula | C48H78O16 |
| Exact Mass | 910.528986 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ygoUYtxF0N |
|---|---|
| Name | ROTUNDIOSIDE-F |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O16 |
| InChI | InChI=1S/C48H78O16/c1-22-30(51)33(54)36(57)39(59-22)63-38-35(56)32(53)24(20-49)61-41(38)64-37-34(55)31(52)23(2)60-40(37)62-29-12-13-44(7)25(43(29,5)6)10-14-45(8)26(44)11-15-48-27-18-42(3,4)16-17-47(27,21-58-48)28(50)19-46(45,48)9/h11,15,22-41,49-57H,10,12-14,16-21H2,1-9H3/t22-,23+,24+,25?,26?,27?,28+,29-,30-,31-,32+,33+,34-,35-,36+,37+,38+,39-,40-,41-,44-,45+,46-,47+,48-/m0/s1 |
| InChIKey | HMEMJYQIFNQSFR-OULLDVHZSA-N |
| Literature Reference Author | E.AKAI,T.TAKEDA,Y.KOBAYASHI,Y.CHEN,Y.OGIHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,33,4685(1985) |
| Literature Reference DOI | 10.1248/cpb.33.4685 |
| Molecular Weight | 911.138 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK215 |