| SpectraBase Compound ID | OFCK9thQQ8 |
|---|---|
| InChI | InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-37(59)34(56)38(66-41-36(58)32(54)30(52)22(3)63-41)26(65-42)18-62-40-35(57)33(55)31(53)25(17-49)64-40/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22-,24-,25-,26-,27-,28-,29+,30+,31-,32-,33+,34-,35-,36+,37-,38-,39-,40-,41-,42+,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | YORPBHMQWOPCMC-IEDRRIPISA-N |
| Mol Weight | 959.1 g/mol |
| Molecular Formula | C48H78O19 |
| Exact Mass | 958.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CBW3LbmOUcC |
|---|---|
| Name | ASIATICOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O19 |
| InChI | InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-37(59)34(56)38(66-41-36(58)32(54)30(52)22(3)63-41)26(65-42)18-62-40-35(57)33(55)31(53)25(17-49)64-40/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22-,24-,25-,26-,27-,28-,29+,30+,31-,32-,33+,34-,35-,36+,37-,38-,39-,40-,41-,42+,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | YORPBHMQWOPCMC-IEDRRIPISA-N |
| Literature Reference Author | T.V.SUNG,C.LAVAUD,A.PORZEL,W.STEGLICH,G.ADAM |
| Literature Reference Citation | PHYTOCHEM.,31,227(1992) |
| Literature Reference DOI | 10.1016/0031-9422(91)83042-J |
| Molecular Weight | 959.136 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU5266 |