| SpectraBase Compound ID | 2C4SeOukdpb |
|---|---|
| InChI | InChI=1S/C45H74O19/c1-19(16-58-41-38(55)35(52)33(50)29(15-46)62-41)6-11-45(57-5)20(2)31-28(64-45)14-24-22-13-26(47)25-12-21(7-9-43(25,3)23(22)8-10-44(24,31)4)61-42-39(56)36(53)34(51)30(63-42)18-60-40-37(54)32(49)27(48)17-59-40/h19-25,27-42,46,48-56H,6-18H2,1-5H3/t19-,20+,21+,22-,23+,24+,25-,27+,28+,29+,30-,31+,32+,33+,34-,35-,36+,37-,38+,39-,40+,41+,42-,43-,44+,45+/m1/s1 |
| InChIKey | FBDLRVGMNMBBNW-RXYOGKJSSA-N |
| Mol Weight | 919.1 g/mol |
| Molecular Formula | C45H74O19 |
| Exact Mass | 918.48243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8734pJLfDiz |
|---|---|
| Name | 26-O-BETA-D-GLUCOPYRANOSYL-3-BETA,26-DIHYDROXY-(25R)-5-ALPHA-FUROSTAN-22-METHOXY-6-ONE-3-O-ALPHA-L-ARABINOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H74O19 |
| InChI | InChI=1S/C45H74O19/c1-19(16-58-41-38(55)35(52)33(50)29(15-46)62-41)6-11-45(57-5)20(2)31-28(64-45)14-24-22-13-26(47)25-12-21(7-9-43(25,3)23(22)8-10-44(24,31)4)61-42-39(56)36(53)34(51)30(63-42)18-60-40-37(54)32(49)27(48)17-59-40/h19-25,27-42,46,48-56H,6-18H2,1-5H3/t19-,20+,21+,22-,23+,24+,25-,27+,28+,29+,30-,31+,32+,33+,34-,35-,36+,37-,38+,39-,40+,41+,42-,43-,44+,45+/m1/s1 |
| InChIKey | FBDLRVGMNMBBNW-RXYOGKJSSA-N |
| Literature Reference Author | J.XU,S.FENG,Q.WANG,Y.CAO,M.SUN,C.ZHANG |
| Literature Reference Citation | MOLECULES,19,20975(2014) |
| Literature Reference DOI | 10.3390/molecules191220975 |
| Molecular Weight | 919.071 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU81650 |