| SpectraBase Compound ID | HYw2p5cZP8X |
|---|---|
| InChI | InChI=1S/C45H74O18/c1-19(18-57-40-37(54)35(52)32(49)28(16-46)60-40)8-13-45(56)20(2)30-27(63-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)59-42-39(36(53)33(50)29(17-47)61-42)62-41-38(55)34(51)31(48)21(3)58-41/h14,19-21,23-42,46-56H,6-13,15-18H2,1-5H3/t19-,20-,21-,23-,24+,25-,26-,27-,28-,29+,30-,31-,32-,33+,34+,35+,36-,37-,38+,39+,40-,41-,42+,43-,44-,45?/m0/s1 |
| InChIKey | LWXZBNGSFONONO-PTKQGYOHSA-N |
| Mol Weight | 903.1 g/mol |
| Molecular Formula | C45H74O18 |
| Exact Mass | 902.487516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2yIyB3IdLTG |
|---|---|
| Name | TRIGONEOSIDE-XIIB;26-O-BETA-D-GLUCOPYRANOSYL-(25R)-FUROST-4-ENE-3-BETA,22-XI,26-TRIOL-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H74O18 |
| InChI | InChI=1S/C45H74O18/c1-19(18-57-40-37(54)35(52)32(49)28(16-46)60-40)8-13-45(56)20(2)30-27(63-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)59-42-39(36(53)33(50)29(17-47)61-42)62-41-38(55)34(51)31(48)21(3)58-41/h14,19-21,23-42,46-56H,6-13,15-18H2,1-5H3/t19-,20-,21-,23-,24+,25-,26-,27-,28-,29+,30-,31-,32-,33+,34+,35+,36-,37-,38+,39+,40-,41-,42+,43-,44-,45?/m0/s1 |
| InChIKey | LWXZBNGSFONONO-PTKQGYOHSA-N |
| Literature Reference Author | T.MURAKAMI,A.KISHI,H.MATSUDA,M.YOSHIKAWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,994(2000) |
| Literature Reference DOI | 10.1248/cpb.48.994 |
| Molecular Weight | 903.072 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4342 |