| SpectraBase Compound ID | LQDHW7wEYxS |
|---|---|
| InChI | InChI=1S/C48H78O20/c1-43(2)11-13-48(42(62)68-41-37(34(59)31(56)26(19-51)65-41)66-39-35(60)32(57)29(54)24(17-49)63-39)14-12-46(5)21(22(48)15-43)7-8-28-44(3)16-23(53)38(45(4,20-52)27(44)9-10-47(28,46)6)67-40-36(61)33(58)30(55)25(18-50)64-40/h7,22-41,49-61H,8-20H2,1-6H3/t22-,23-,24+,25+,26+,27+,28+,29+,30+,31+,32-,33-,34-,35+,36+,37+,38-,39-,40-,41-,44-,45-,46+,47+,48-/m0/s1 |
| InChIKey | KVMFZXMNHQTAEZ-MDRLCWBPSA-N |
| Mol Weight | 975.1 g/mol |
| Molecular Formula | C48H78O20 |
| Exact Mass | 974.508645 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7qWnj4kEQRo |
|---|---|
| Name | ASTERYUNNANOSIDE-E;3-O-BETA-D-GLUCOPYRANOSYL-BAYOGENIN-28-O-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H78O20 |
| InChI | InChI=1S/C48H78O20/c1-43(2)11-13-48(42(62)68-41-37(34(59)31(56)26(19-51)65-41)66-39-35(60)32(57)29(54)24(17-49)63-39)14-12-46(5)21(22(48)15-43)7-8-28-44(3)16-23(53)38(45(4,20-52)27(44)9-10-47(28,46)6)67-40-36(61)33(58)30(55)25(18-50)64-40/h7,22-41,49-61H,8-20H2,1-6H3/t22-,23-,24+,25+,26+,27+,28+,29+,30+,31+,32-,33-,34-,35+,36+,37+,38-,39-,40-,41-,44-,45-,46+,47+,48-/m0/s1 |
| InChIKey | KVMFZXMNHQTAEZ-MDRLCWBPSA-N |
| Literature Reference Author | Y.SHAO,B.N.ZHOU,J.H.GAO,L.Z.LIN,G.A.CORDELL |
| Literature Reference Citation | PHYTOCHEM.,38,675(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00716-7 |
| Molecular Weight | 975.135 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS4887 |