| SpectraBase Compound ID | 4N0eYxrRfP6 |
|---|---|
| InChI | InChI=1S/C47H76O17/c1-21-11-16-47(41(57)64-39-35(56)33(54)31(52)25(19-48)61-39)18-17-44(6)23(37(47)46(21,8)58)9-10-27-43(5)14-13-28(42(3,4)26(43)12-15-45(27,44)7)62-40-36(30(51)24(49)20-59-40)63-38-34(55)32(53)29(50)22(2)60-38/h9,21-22,24-40,48-56,58H,10-20H2,1-8H3/t21-,22+,24+,25-,26?,27?,28+,29+,30+,31-,32-,33+,34-,35-,36-,37?,38+,39+,40+,43+,44-,45-,46-,47+/m1/s1 |
| InChIKey | WZIPJKRPXMPATM-FVKVCCJCSA-N |
| Mol Weight | 913.1 g/mol |
| Molecular Formula | C47H76O17 |
| Exact Mass | 912.508251 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7N5T79lNxdK |
|---|---|
| Name | RANDIASAPONIN-IV;3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-POMOLIC-ACID-28-BETA-D-GLUCOPYRANOSYLESTER |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O17 |
| InChI | InChI=1S/C47H76O17/c1-21-11-16-47(41(57)64-39-35(56)33(54)31(52)25(19-48)61-39)18-17-44(6)23(37(47)46(21,8)58)9-10-27-43(5)14-13-28(42(3,4)26(43)12-15-45(27,44)7)62-40-36(30(51)24(49)20-59-40)63-38-34(55)32(53)29(50)22(2)60-38/h9,21-22,24-40,48-56,58H,10-20H2,1-8H3/t21-,22+,24+,25-,26?,27?,28+,29+,30+,31-,32-,33+,34-,35-,36-,37?,38+,39+,40+,43+,44-,45-,46-,47+/m1/s1 |
| InChIKey | WZIPJKRPXMPATM-FVKVCCJCSA-N |
| Literature Reference Author | S.SAHPAZ,M.P.GUPTA,K.HOSTETTMANN |
| Literature Reference Citation | PHYTOCHEM.,54,77(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00034-0 |
| Molecular Weight | 913.110 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU1224 |