| SpectraBase Compound ID | FBYepgwx7bg |
|---|---|
| InChI | InChI=1S/C48H78O18/c1-43(2)14-16-48(17-15-46(6)22(23(48)18-43)8-9-28-45(5)12-11-29(51)44(3,4)27(45)10-13-47(28,46)7)42(60)66-40-37(59)34(56)32(54)26(64-40)21-61-41-38(35(57)31(53)25(20-50)63-41)65-39-36(58)33(55)30(52)24(19-49)62-39/h8,23-41,49-59H,9-21H2,1-7H3/t23?,24-,25-,26-,27?,28?,29+,30-,31-,32-,33+,34+,35+,36-,37-,38-,39+,40+,41-,45+,46-,47-,48+/m1/s1 |
| InChIKey | ASZPBNMFJLYXDL-QWDODFKXSA-N |
| Mol Weight | 943.1 g/mol |
| Molecular Formula | C48H78O18 |
| Exact Mass | 942.518816 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LHfS8aAUc4K |
|---|---|
| Name | ROTUNDIOSIDE-B-3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O18 |
| InChI | InChI=1S/C48H78O18/c1-43(2)14-16-48(17-15-46(6)22(23(48)18-43)8-9-28-45(5)12-11-29(51)44(3,4)27(45)10-13-47(28,46)7)42(60)66-40-37(59)34(56)32(54)26(64-40)21-61-41-38(35(57)31(53)25(20-50)63-41)65-39-36(58)33(55)30(52)24(19-49)62-39/h8,23-41,49-59H,9-21H2,1-7H3/t23?,24-,25-,26-,27?,28?,29+,30-,31-,32-,33+,34+,35+,36-,37-,38-,39+,40+,41-,45+,46-,47-,48+/m1/s1 |
| InChIKey | ASZPBNMFJLYXDL-QWDODFKXSA-N |
| Literature Reference Author | E.AKAI,T.TAKEDO,Y.KOBAYASHI,Y.OGIHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,33,3715(1985) |
| Literature Reference DOI | 10.1248/cpb.33.3715 |
| Molecular Weight | 943.137 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK606 |