![3-O-BETA-[GLUCOPYRANOSYL-(1->4)-GLUCOPYRANOSYL-(1->2)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID](/api/spectrum/7Tho9VmrOAk/structure.png?h=300&w=458 "3-O-BETA-[GLUCOPYRANOSYL-(1->4)-GLUCOPYRANOSYL-(1->2)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID")
| SpectraBase Compound ID | DpRXsUtGtmK |
|---|---|
| InChI | InChI=1S/C49H78O19/c1-44(2)15-17-49(43(60)61)18-16-47(6)22(23(49)19-44)9-10-27-46(5)13-12-28(45(3,4)26(46)11-14-48(27,47)7)65-42-38(32(55)31(54)37(67-42)39(59)62-8)68-41-35(58)33(56)36(25(21-51)64-41)66-40-34(57)30(53)29(52)24(20-50)63-40/h9,23-38,40-42,50-58H,10-21H2,1-8H3,(H,60,61)/t23?,24-,25+,26?,27?,28-,29-,30+,31-,32-,33+,34-,35+,36+,37-,38+,40+,41-,42+,46-,47+,48+,49-/m0/s1 |
| InChIKey | QAAIJVZCSNNUPW-VOAGBMOMSA-N |
| Mol Weight | 971.1 g/mol |
| Molecular Formula | C49H78O19 |
| Exact Mass | 970.51373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Tho9VmrOAk |
|---|---|
| Name | 3-O-BETA-[GLUCOPYRANOSYL-(1->4)-GLUCOPYRANOSYL-(1->2)-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C49H78O19 |
| InChI | InChI=1S/C49H78O19/c1-44(2)15-17-49(43(60)61)18-16-47(6)22(23(49)19-44)9-10-27-46(5)13-12-28(45(3,4)26(46)11-14-48(27,47)7)65-42-38(32(55)31(54)37(67-42)39(59)62-8)68-41-35(58)33(56)36(25(21-51)64-41)66-40-34(57)30(53)29(52)24(20-50)63-40/h9,23-38,40-42,50-58H,10-21H2,1-8H3,(H,60,61)/t23?,24-,25+,26?,27?,28-,29-,30+,31-,32-,33+,34-,35+,36+,37-,38+,40+,41-,42+,46-,47+,48+,49-/m0/s1 |
| InChIKey | QAAIJVZCSNNUPW-VOAGBMOMSA-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 | 971.147 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1188 |