![3-O-[BETA-QUINOVOPYRANOSYL-(1->6)-BETA-GLUCOPYRANOSYL-(1->6)-BETA-GLUCOPYRANOSYL]-CHLOROGENIN](/api/spectrum/Gl2Ah0JDB9l/structure.png?h=300&w=458 "3-O-[BETA-QUINOVOPYRANOSYL-(1->6)-BETA-GLUCOPYRANOSYL-(1->6)-BETA-GLUCOPYRANOSYL]-CHLOROGENIN")
| SpectraBase Compound ID | KjEeIdwobld |
|---|---|
| InChI | InChI=1S/C45H74O18/c1-18-6-11-45(58-15-18)19(2)30-27(63-45)14-24-22-13-26(46)25-12-21(7-9-43(25,4)23(22)8-10-44(24,30)5)60-42-39(55)36(52)33(49)29(62-42)17-57-41-38(54)35(51)32(48)28(61-41)16-56-40-37(53)34(50)31(47)20(3)59-40/h18-42,46-55H,6-17H2,1-5H3/t18?,19-,20+,21-,22?,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 | GLFZZIUYGQICFL-BZSUXYKSSA-N |
| Mol Weight | 903.1 g/mol |
| Molecular Formula | C45H74O18 |
| Exact Mass | 902.487516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Gl2Ah0JDB9l |
|---|---|
| Name | 3-O-[BETA-QUINOVOPYRANOSYL-(1->6)-BETA-GLUCOPYRANOSYL-(1->6)-BETA-GLUCOPYRANOSYL]-CHLOROGENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H74O18 |
| InChI | InChI=1S/C45H74O18/c1-18-6-11-45(58-15-18)19(2)30-27(63-45)14-24-22-13-26(46)25-12-21(7-9-43(25,4)23(22)8-10-44(24,30)5)60-42-39(55)36(52)33(49)29(62-42)17-57-41-38(54)35(51)32(48)28(61-41)16-56-40-37(53)34(50)31(47)20(3)59-40/h18-42,46-55H,6-17H2,1-5H3/t18?,19-,20+,21-,22?,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 | GLFZZIUYGQICFL-BZSUXYKSSA-N |
| Literature Reference Author | L.ALVAREZ,M.DEL_CARMEN_PEREZ,J.L.GONZALEZ,V.NAVARRO,M.L.VILL AREAL,J.O.OLSON |
| Literature Reference Citation | PLANTA.MED.,67,372(2001) |
| Literature Reference DOI | 10.1055/s-2001-14332 |
| Molecular Weight | 903.072 g/mol |
| Solvent | C5D5N |
| Source File Reference | UIAP1558 |