![3-O-BETA-[GALACTOPYRANOSYL-(1->4)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-HEDERAGENIN](/api/spectrum/LusFi9Ld5U4/structure.png?h=300&w=458 "3-O-BETA-[GALACTOPYRANOSYL-(1->4)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-HEDERAGENIN")
| SpectraBase Compound ID | 5ZxaheGzbc2 |
|---|---|
| InChI | InChI=1S/C43H68O15/c1-38(2)14-16-43(37(52)53)17-15-41(5)21(22(43)18-38)8-9-25-39(3)12-11-26(40(4,20-45)24(39)10-13-42(25,41)6)56-36-31(50)29(48)32(33(58-36)34(51)54-7)57-35-30(49)28(47)27(46)23(19-44)55-35/h8,22-33,35-36,44-50H,9-20H2,1-7H3,(H,52,53)/t22?,23-,24?,25?,26-,27+,28+,29+,30-,31+,32-,33-,35+,36+,39-,40-,41+,42+,43-/m0/s1 |
| InChIKey | GEHQBXDDQXAGNX-QVXOJHAWSA-N |
| Mol Weight | 825.0 g/mol |
| Molecular Formula | C43H68O15 |
| Exact Mass | 824.455821 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 | LusFi9Ld5U4 |
|---|---|
| Name | 3-O-BETA-[GALACTOPYRANOSYL-(1->4)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-HEDERAGENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H68O15 |
| InChI | InChI=1S/C43H68O15/c1-38(2)14-16-43(37(52)53)17-15-41(5)21(22(43)18-38)8-9-25-39(3)12-11-26(40(4,20-45)24(39)10-13-42(25,41)6)56-36-31(50)29(48)32(33(58-36)34(51)54-7)57-35-30(49)28(47)27(46)23(19-44)55-35/h8,22-33,35-36,44-50H,9-20H2,1-7H3,(H,52,53)/t22?,23-,24?,25?,26-,27+,28+,29+,30-,31+,32-,33-,35+,36+,39-,40-,41+,42+,43-/m0/s1 |
| InChIKey | GEHQBXDDQXAGNX-QVXOJHAWSA-N |
| Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
| Molecular Weight | 825.004 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1137 |