| SpectraBase Compound ID | KM0BhrpG45w |
|---|---|
| InChI | InChI=1S/C47H76O19/c1-20-28(53)31(56)33(58)38(62-20)64-35-29(54)25(52)18-61-40(35)66-41(60)47-12-10-42(2,3)14-22(47)21-8-9-27-43(4)15-24(51)37(65-39-34(59)32(57)30(55)26(17-48)63-39)44(5,19-49)36(43)23(50)16-46(27,7)45(21,6)11-13-47/h8,20,22-40,48-59H,9-19H2,1-7H3/t20-,22?,23+,24-,25-,26+,27?,28-,29-,30+,31+,32-,33+,34+,35+,36?,37-,38-,39-,40-,43+,44-,45+,46+,47-/m0/s1 |
| InChIKey | JUXWBGYLESHCHB-DTUZUPICSA-N |
| Mol Weight | 945.1 g/mol |
| Molecular Formula | C47H76O19 |
| Exact Mass | 944.49808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 15Ay9boACDE |
|---|---|
| Name | MIMUSOPSIDE-A;3-O-BETA-D-GLUCOPYRANOSYL-PROTOBASSIC-ACID-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O19 |
| InChI | InChI=1S/C47H76O19/c1-20-28(53)31(56)33(58)38(62-20)64-35-29(54)25(52)18-61-40(35)66-41(60)47-12-10-42(2,3)14-22(47)21-8-9-27-43(4)15-24(51)37(65-39-34(59)32(57)30(55)26(17-48)63-39)44(5,19-49)36(43)23(50)16-46(27,7)45(21,6)11-13-47/h8,20,22-40,48-59H,9-19H2,1-7H3/t20-,22?,23+,24-,25-,26+,27?,28-,29-,30+,31+,32-,33+,34+,35+,36?,37-,38-,39-,40-,43+,44-,45+,46+,47-/m0/s1 |
| InChIKey | JUXWBGYLESHCHB-DTUZUPICSA-N |
| Literature Reference Author | N.P.SAHU |
| Literature Reference Citation | PHYTOCHEM.,41,883(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00690-7 |
| Molecular Weight | 945.109 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU4105 |