![#1;REBAUDIOSIDE-A;13-[(2-O-BETA-D-GLUCOPYRANOSYL-3-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSYL)-OXY]-ENT-KAUR-16-EN-19-OIC-ACID-BETA-D-GLUCOPYRANOSYLE](/api/spectrum/EMtIy6xpjxe/structure.png?h=300&w=458 "#1;REBAUDIOSIDE-A;13-[(2-O-BETA-D-GLUCOPYRANOSYL-3-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSYL)-OXY]-ENT-KAUR-16-EN-19-OIC-ACID-BETA-D-GLUCOPYRANOSYLE")
| SpectraBase Compound ID | B1IUtJOlQ8U |
|---|---|
| InChI | InChI=1S/C44H70O23/c1-17-11-43-9-5-22-41(2,7-4-8-42(22,3)40(59)66-38-33(58)30(55)26(51)20(14-47)62-38)23(43)6-10-44(17,16-43)67-39-35(65-37-32(57)29(54)25(50)19(13-46)61-37)34(27(52)21(15-48)63-39)64-36-31(56)28(53)24(49)18(12-45)60-36/h18-39,45-58H,1,4-16H2,2-3H3/t18-,19+,20+,21-,22+,23+,24-,25+,26+,27-,28+,29-,30-,31-,32+,33+,34+,35-,36+,37-,38-,39+,41-,42-,43-,44+/m1/s1 |
| InChIKey | HELXLJCILKEWJH-JKJZLHQSSA-N |
| Mol Weight | 967.0 g/mol |
| Molecular Formula | C44H70O23 |
| Exact Mass | 966.430788 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EMtIy6xpjxe |
|---|---|
| Name | #1;REBAUDIOSIDE-A;13-[(2-O-BETA-D-GLUCOPYRANOSYL-3-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSYL)-OXY]-ENT-KAUR-16-EN-19-OIC-ACID-BETA-D-GLUCOPYRANOSYLE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H70O23 |
| InChI | InChI=1S/C44H70O23/c1-17-11-43-9-5-22-41(2,7-4-8-42(22,3)40(59)66-38-33(58)30(55)26(51)20(14-47)62-38)23(43)6-10-44(17,16-43)67-39-35(65-37-32(57)29(54)25(50)19(13-46)61-37)34(27(52)21(15-48)63-39)64-36-31(56)28(53)24(49)18(12-45)60-36/h18-39,45-58H,1,4-16H2,2-3H3/t18-,19+,20+,21-,22+,23+,24-,25+,26+,27-,28+,29-,30-,31-,32+,33+,34+,35-,36+,37-,38-,39+,41-,42-,43-,44+/m1/s1 |
| InChIKey | HELXLJCILKEWJH-JKJZLHQSSA-N |
| Literature Reference Author | V.S.P.CHATURVEDULA,O.YU,G.MAO |
| Literature Reference Citation | INT.J.PH.SCI.INV.,2,36(2013) |
| Molecular Weight | 967.026 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWBT16736 |