![3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[XYLOPYRANOSYL-(1->2)]-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID](/api/spectrum/JeinjjDXJzn/structure.png?h=300&w=458 "3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[XYLOPYRANOSYL-(1->2)]-(6-O-METHYL)-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID")
| SpectraBase Compound ID | F4tnNc9NggC |
|---|---|
| InChI | InChI=1S/C48H76O18/c1-43(2)15-17-48(42(58)59)18-16-46(6)22(23(48)19-43)9-10-27-45(5)13-12-28(44(3,4)26(45)11-14-47(27,46)7)63-41-37(66-39-32(54)29(51)24(50)21-61-39)35(34(56)36(65-41)38(57)60-8)64-40-33(55)31(53)30(52)25(20-49)62-40/h9,23-37,39-41,49-56H,10-21H2,1-8H3,(H,58,59)/t23?,24-,25-,26?,27?,28+,29+,30-,31+,32-,33-,34+,35+,36+,37-,39+,40+,41-,45+,46-,47-,48+/m1/s1 |
| InChIKey | HPYYLIGQDHEPPH-MKGZCGCESA-N |
| Mol Weight | 941.1 g/mol |
| Molecular Formula | C48H76O18 |
| Exact Mass | 940.503166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JeinjjDXJzn |
|---|---|
| Name | 3-O-BETA-[GLUCOPYRANOSYL-(1->3)-[XYLOPYRANOSYL-(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 | C48H76O18 |
| InChI | InChI=1S/C48H76O18/c1-43(2)15-17-48(42(58)59)18-16-46(6)22(23(48)19-43)9-10-27-45(5)13-12-28(44(3,4)26(45)11-14-47(27,46)7)63-41-37(66-39-32(54)29(51)24(50)21-61-39)35(34(56)36(65-41)38(57)60-8)64-40-33(55)31(53)30(52)25(20-49)62-40/h9,23-37,39-41,49-56H,10-21H2,1-8H3,(H,58,59)/t23?,24-,25-,26?,27?,28+,29+,30-,31+,32-,33-,34+,35+,36+,37-,39+,40+,41-,45+,46-,47-,48+/m1/s1 |
| InChIKey | HPYYLIGQDHEPPH-MKGZCGCESA-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 | 941.121 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1162 |